Phytochemical database

No Ligand ID Drug Group Generic Name Name of Plant MW Smile Edit
1001 HB01001 Phytochemical platycoside G3 Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1C(C(C(CO1)O)O)OC1C(C(C(C(O1)C)OC1C(C(C(CO1)O)OC1OCC(C1O)(O)CO)O)O)O)C)C)C)(C)CO)OC1C(C(C(C(O1)COC1C(C(C(C(O1)CO)O)O)O)O)O)O)O
1002 HB01002 Phytochemical platycoside J Platycodon grandiflorum, Platycodon grandiflorum, Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(OO)[C@H]1[C@H](OC2[C@@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)CO3)[C@H](O2)C)[C@@H](O)[C@@H](O)CO1)C)C)C)(C)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H
1003 HB01003 Phytochemical 3-O-beta-D-glucopyranosyl polygalacic acid Platycodon grandiflorum 666.84 [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O
1004 HB01004 Phytochemical 3-O-beta-D-laminaribiosyl polygalacic acid Platycodon grandiflorum 828.98 [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)CO)OC1[C@@H](C([C@H](C(O1)CO)O)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O)O
1005 HB01005 Phytochemical 3'-O-acetylpolygalacin D Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)OC1[C@@H]([C@@H]([C@H]([C@@H](O1)C)OC1OC[C@H]([C@@H]([C@H]1O)OC1OC[C@]([C@H]1O)(O)CO)O)OC(=O)C)O)C)C)C)(C)CO)O[C@H]1[C@H](O)[C
1006 HB01006 Phytochemical 3'-O-acetylpolygalacin D2 Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)OC1[C@@H]([C@@H]([C@H]([C@@H](O1)C)OC1OC[C@H]([C@@H]([C@H]1O)OC1OC[C@]([C@H]1O)(O)CO)O)OC(=O)C)O)C)C)C)(C)CO)OC1[C@@H](C([C@H]
1007 HB01007 Phytochemical platycoside D Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)O)C)C)C)(C)CO)OC1[C@@H](C([C@H](C(O1)COC1[C@@H](C([C@
1008 HB01008 Phytochemical 2'-O-acetylpolygalacin D Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)OC(=O)C)C)C)C)(C)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[
1009 HB01009 Phytochemical polygalacin D Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@](CO1)(CO)O)O)O)O)O)C)C)C)(C)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1010 HB01010 Phytochemical 2'-O-Acetyl polygalacin D Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@](CO1)(CO)O)O)OC(=O)C)O)O)C)C)C)(C)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1011 HB01011 Phytochemical Platycogenic acid B Platycodon grandiflorum 534.68 [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@]([C@H](C2)O)(C[C@@H](C(C1)(C)C)O)C(=O)O)C)C)C)(C(=O)O)C)O)O
1012 HB01012 Phytochemical Platycogenic acid A Platycodon grandiflorum 534.68 [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@]([C@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(C(=O)O)CO)O)O
1013 HB01013 Phytochemical Polygalacic acid Platycodon grandiflorum 504.70 [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@](C(C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)CO)O)O
1014 HB01014 Phytochemical platyconic acid A Platycodon grandiflorum [C@H]1([C@@H]([C@@](C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@](C(C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)O)C)C)C)(C(=O)O)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1015 HB01015 Phytochemical nuezhengalaside Ligustrum lucidum 388.41 [C@H]1([C@@H]([C@@H]([C@@H]([C@@H](O1)OC1/C(=C/C)/C(C(=CO1)C(=O)OC)CCC)O)O)O)CO
1016 HB01016 Phytochemical isorhamnetin 3-rhamnoside Prunus mume, Prunus mume [C@H]1([C@@H]([C@@H]([C@@H](O[C@H]1C)Oc1c(oc2c(=C([CH]C(=C2)O)O)c1=O)c1ccc(c(c1)OC)O)O)O)O
1017 HB01017 Phytochemical cimidahurine Cimicifuga foetida, Cimicifuga dahurica (Turcz.) Maxim. 316.30 [C@H]1([C@@H]([C@@H]([C@H]([C@@H](O1)Oc1c(ccc(c1)CCO)O)O)O)O)CO
1018 HB01018 Phytochemical manninotriose Rehmannia glutinosa (Gaertn.) Libosch ex Mey., Alisma orientalis 504.44 [C@H]1([C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](C=O)O)O)O)O)O)O)O)CO
1019 HB01019 Phytochemical Sarcovaging A Sarcococca vagans Stapf 460.69 [C@H]1([C@@H]([C@@H](C2C(C1)(C1C(CC2)C2C(CC1)(C(CC2)C(C)N(C)C)C)C)O)NC(=O)/C(=C/C)/C)O
1020 HB01020 Phytochemical Methyl-3-O-?-D-glucopyranosyl polygalacate Platycodon grandiflorum 680.87 [C@H]1([C@@H]([C@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC)C)C)C)(CO)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O
1021 HB01021 Phytochemical Esculentoside H Phytolacca americana L. 989.10 [C@H]1([C@@H]([C@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CC[C@](C1)(C)C(=O)OC)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)C)C)(CO)C)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O
1022 HB01022 Phytochemical polygalacin D2 Platycodon grandiflorum [C@H]1([C@@H]([C@](C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)O)C)C)C)(CO)C)OC1[C@@H](C([C@H](C(O1)CO)O)O[C@H]1[C@H
1023 HB01023 Phytochemical L(+)-Bornesitol Thevetia nerllfolia 194.18 [C@H]1([C@@H]([C@H]([C@@H]([C@@H]([C@@H]1OC)O)O)O)O)O
1024 HB01024 Phytochemical (2S)-1,2-Di-O-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]-3-O-?-D-galactopyranosyl glycerol Rosa canina 773.09 [C@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)OC[C@@H](CCC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)O)O)O
1025 HB01025 Phytochemical ?,?-Digalactosyl-?'-linolenic-glyceride Setaria italica (L.) Beauv. 676.79 [C@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)OC[C@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O)O)O
1026 HB01026 Phytochemical 1-O-?-D-Galactosyl (6?1)-?-D-galactosyl-2,3-O-dihexadecanoyl-glycerol Matteuccia struthiopteris (L.) Todaro 893.19 [C@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)OC[C@@H](OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)O)O)O
1027 HB01027 Phytochemical ikarisoside F Epimedium wushanese, Epimedium sagittatum, Epimedium pubescens, Epimedium brevicornum, Epimedium koreanum 632.61 [C@H]1([C@@H]([C@H]([C@@H](O[C@H]1O[C@H]1[C@@H](OC[C@H]([C@@H]1O)O)Oc1c(c2ccc(cc2)O)oc2c(c1=O)c(cc(c2CC=C(C)C)O)O)C)O)O)O
1028 HB01028 Phytochemical Patrinia scabiosaefolia Fisch Patrinia scabiosaefolia 750.96 [C@H]1([C@@H]([C@H]([C@@H](OC1)O[C@H]1[C@@]([C@@H]2[C@](CC1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)CO)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)O
1029 HB01029 Phytochemical 3-Butenyl-6'-O-?-L-arabinopyranosyl-?-D-glucopyranoside Swertia japonica 366.36 [C@H]1([C@@H]([C@H]([C@@H](OC1)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OCCC=C)O)O)O)O)O)O
1030 HB01030 Phytochemical Rhamnose Panax ginseng C. A. Mey., Aloe. vera L., Oplopanax elatus Nakai, Typha angustifolia L. 164.16 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)O)O)O)O)C
1031 HB01031 Phytochemical Parillin Smilax aristolochiaefolia, Holarrhena antidysenterica Wall. [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]1[C@H](O[C@H]([C@@H]([C@@H]1O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1C[C@H]1[C@@H]2[C@@H]([C@@]2(O1)OCC(CC2)C)C)C)C)CO[C@H]1[C@@H]([C@@H]([C@@H]([C@H](
1032 HB01032 Phytochemical Pariphyllin Paris polyphylla Smith. var. yunnanensis, Paris polyphylla Smith 855.02 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]1[C@H](O[C@H]([C@@H]([C@@H]1O[C@H]1[C@@H]([C@@H]([C@@H](O1)CO)O)O)O)O[C@H]1CCC2(C(=CCC3C2CCC2(C3CC3C2C(C2(O3)CCC(CO2)C)C)C)C1)C)CO)O)O)O)C
1033 HB01033 Phytochemical Rehmannioside B Rehmannia glutinosa (Gaertn.) Libosch ex Mey., Rehmannia glutinosa, Rehmannia glutinosa (Gaertn.) Libosch ex Mey. 524.47 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]1C2C([C@@H]3[C@H]1C=CO[C@H]3O[C@@H]1O[C@@H]([C@H]([C@H]([C@H]1O)O)O)CO)(O2)CO)O)O)O)CO
1034 HB01034 Phytochemical Rehmannioside C Rehmannia glutinosa (Gaertn.) Libosch ex Mey., Rehmannia glutinosa, Rehmannia glutinosa (Gaertn.) Libosch ex Mey. 510.49 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]1CC([C@@H]2[C@H]1C=CO[C@H]2O[C@@H]1O[C@@H]([C@H]([C@H]([C@H]1O)O)O)CO)(C)O)O)O)O)CO
1035 HB01035 Phytochemical Patrinoside D Patrinia scabiosaefolia Fisch. [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC(=O)[C@@]12[C@@](CC(CC1)(C)C)(C1=CCC3[C@](C1(CC2)C)(CCC1[C@@]3(CCC(C1(C)C)O[C@H]1[C@@H]([C@@H]([C@@H](CO1)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)C)O)O)O[C@H]1[C@@H]([C@@H]([C@@H](CO1)O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](
1036 HB01036 Phytochemical Patrinoside C Patrinia scabiosaefolia Fisch. [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC(=O)C12[C@@H](CC(CC1)(C)C)C1=CCC3[C@](C1(CC2)C)(CCC1[C@@]3(CC[C@@H](C1(C)C)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)C)O)OC1[C@@H]([C@@H]([C@H](O1)C(CO)O)O)O[C@H]1[C@@H]([C@@H]([C@@H](CO1)O)O)O)O)C)C)O)O)OC1[C@@H]([C@@H]([
1037 HB01037 Phytochemical Cyanidin-3-rutinoside-5-glucoside Hibiscus mutabilis L. 780.68 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]1[C@H]([C@H]([C@H]([C@@H](O1)OC1=Cc2c([O+937]=C1c1ccc(c(c1)O)O)cc(cc2O[C@@H]1C[C@H]([C@H]([C@@H]([C@@H]1O)O)O)CO)O)O)O)O)O)O)O)C
1038 HB01038 Phytochemical Cyanidin-3-rutinoside Syzygium cumini (L.) Skeels, Syzygium cumini (L.) Skeels, Antirrhinum majus, Antirrhinum majus, Abutilon indicum (L.) Sweet 620.52 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]1[C@H](C([C@H]([C@@H](O1)OC1=Cc2c([O+937]=C1c1ccc(c(c1)O)O)cc(cc2O)O)O)O)O)O)O)O)C
1039 HB01039 Phytochemical Eleutheroside B1 Acanthopanax gracilistylus 384.34 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)Oc1c(c2c(cc1OC)ccc(=O)o2)OC)O)O)O)CO
1040 HB01040 Phytochemical Mukurozioside I Sapindus mukorossi Gaertn., Sapindus mukorossi Gaertn. 989.06 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC1C(O[C@@H]([C@H]([C@H]1O)O)CO)OCC(CCC/C(=C/CC/C(=C\OC1O[C@@H]([C@H]([C@H](C1OC1O[C@@H]([C@@H]([C@H]([C@H]1O)O)O)C)OC1O[C@@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)CO)/C)/C)C)O)O)O)C
1041 HB01041 Phytochemical Neriifolin Thevetia nerllfolia 534.68 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC1C[C@@H]2[C@](CC1)(C1C(CC2)[C@@]2([C@](CC1)([C@H](CC2)C1=CC(=O)OC1)C)O)C)O)OC)O)C
1042 HB01042 Phytochemical Paridiformoside Lysimachia paridiformis Franch. [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)OC1CCC2(C(C1(C)C)CCC1(C2CCC23C1(CC(C1(C2CC(CC1)(C)C=O)CO3)O)C)C)C)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@H](O1)C)O)O)O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O)CO
1043 HB01043 Phytochemical 3S-(-)-Mucronulatol-7-D-glucopyranoside Astragalus mongholicus Bge. 464.46 [C@H]1([C@@H]([C@H]([C@H]([C@@H](O1)Oc1ccc2c(c1)OCC(C2)c1c(c(c(cc1)OC)O)OC)O)O)O)CO
1044 HB01044 Phytochemical Ruine Peganum harmala L 390.39 [C@H]1([C@@H]([C@H]([C@H]([C@H](O1)Oc1c2c(ccc1OC)c1c(c(ncc1)C)[nH]2)O)O)O)CO
1045 HB01045 Phytochemical Luteolin 7-O-beta-D-galatoside Brucea javanica, Sonchus arvensis L. 448.38 [C@H]1([C@@H]([C@H]([C@H](C(O1)Oc1cc2c(c(c1)O)c(=O)cc(o2)c1cc(c(cc1)O)O)O)O)O)CO
1046 HB01046 Phytochemical Glycerol 2-O-?-L-fucopyranoside Anethum graveolens L. 238.24 [C@H]1([C@@H]([C@H]([C@H](O[C@@H]1C)OC(CO)CO)O)O)O
1047 HB01047 Phytochemical 1-Ethyl-?-D-galactoside Acanthopanax senticosus (Rupr. et Maxim.) Harms, Acanthopanax senticosus (Rupr. et Maxim.) Harms 208.21 [C@H]1([C@@H]([C@H]([C@H](O[C@@H]1CO)OCC)O)O)O
1048 HB01048 Phytochemical Neocrycasin E Cycas revoluta Thunb. 415.37 [C@H]1([C@@H]([C@H](O[C@H]([C@@H]1O)OC1[C@H]([C@H]([C@@H](O[C@@H]1CO)OC/N=N(\O)/C)O)O)CO)O)O
1049 HB01049 Phytochemical kansuinine,d Euphorbia kansui 777.81 [C@H]1([C@@H]([C@H]2[C@](C1)([C@@]1(O[C@@H](C(=O)C1)C([C@@H]([C@@H]([C@H](C(=C)[C@@H]2OC(=O)C)OC(=O)C)OC(=O)c1ccccc1)OC(=C)c1cccnc1)(C)C)O)OC(=O)C)OC(=O)C)C
1050 HB01050 Phytochemical kansuinine,a Euphorbia kansui 716.73 [C@H]1([C@@H]([C@H]2[C@](C1)([C@@]1(O[C@@H](C(=O)C1)C([C@@H]([C@@H]([C@H](C(=C)[C@@H]2OC(=O)C)OC(=O)C)OC(=O)c1ccccc1)OC(=O)C)(C)C)O)OC(=O)C)OC(=O)C)C
1051 HB01051 Phytochemical kansuinine,e Euphorbia kansui 775.84 [C@H]1([C@@H]([C@H]2[C@](C1)(C(=O)C(C1C(C(C(C(C(C(=C)[C@@H]2OC(=O)C)OC(=O)C)OC(=O)c2ccccc2)OC(=C)c2cccnc2)(C)C)O1)C)OC(=O)C)OC(=O)C)C
1052 HB01052 Phytochemical 3-O-?-D-Glucopyranosyl platycodigenin Platycodon grandiflorum 682.84 [C@H]1([C@@H](C([C@@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(CO)CO)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O
1053 HB01053 Phytochemical Astersaponin G Aster tataricus [C@H]1([C@@H](C([C@@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)C)O)O)C)C)C)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C
1054 HB01054 Phytochemical Lushanrubescinsin C lsodon lungshengensis 518.60 [C@H]1([C@@H](C([C@@H]2C(C1)([C@H]1[C@@]3(C[C@@H]2OC(=O)C)C[C@@H](C[C@@H]1OC(=O)C)C(=C)C3=O)C)(C)C)OC(=O)C)OC(=O)C
1055 HB01055 Phytochemical Taibairubescesin A Rabdosia rubescens (Hemsl.) Hara 434.52 [C@H]1([C@@H](C([C@@H]2C(C1)([C@H]1[C@@]3(CC2)C[C@@](C[C@@H]1O)(C(=C)C3=O)O)C)(C)C)OC(=O)C)OC(=O)C
1056 HB01056 Phytochemical Taibairubescesin B Rabdosia rubescens (Hemsl.) Hara 434.52 [C@H]1([C@@H](C([C@@H]2C(C1)([C@H]1[C@@]3(CC2O)C[C@@H](C[C@@H]1OC(=O)C)C(=C)C3=O)C)(C)C)OC(=O)C)O
1057 HB01057 Phytochemical Lungshengenin F lsodon lungshengensis 476.56 [C@H]1([C@@H](C([C@@H]2C(C1O)([C@H]1[C@@]3(CC2)C[C@@H](C[C@@H]1OC(=O)C)C(=C)C3=O)C)(C)C)OC(=O)C)OC(=O)C
1058 HB01058 Phytochemical Lungshengenin G lsodon lungshengensis 490.54 [C@H]1([C@@H](C([C@@H]2C(C1O)([C@H]1[C@@]3(CC2=O)C[C@@H](C[C@@H]1OC(=O)C)C(=C)C3=O)C)(C)C)OC(=O)C)OC(=O)C
1059 HB01059 Phytochemical Phytocassane B Oryza sativa L. 334.45 [C@H]1([C@@H](C([C@H]2[C@]([C@@H]1O)([C@@H]1[C@@H](CC2)[C@H](C(=CC1=O)C=C)C)C)(C)C)O)O
1060 HB01060 Phytochemical Gypenoside LXVII Gynostemma pentaphyllum 948.16 [C@H]1([C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2([C@H](CC1)[C@H](CC2)[C@@](CCC=C(C)C)(C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)C)C)CO)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)
1061 HB01061 Phytochemical 2?-Hydroxyoleanolic acid Rosmarinus officinalis L. 472.70 [C@H]1([C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](CC2)(CCC(C1)(C)C)C(=O)O)C)C)C)(C)C)O)O
1062 HB01062 Phytochemical Digitoxose Metaplexis japonica (Thunb.) Mak. 148.16 [C@H]1([C@@H](C(C[C@@H](O1)O)O)O)C
1063 HB01063 Phytochemical 3-O-beta-D-glucopyranosyl-2 beta,3 beta,16alpha,23,24-pentahydroxyolean-12-ene-28-oic acid Platycodon grandiflorum 682.84 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O
1064 HB01064 Phytochemical platycoside L Platycodon grandiflorum 844.98 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O
1065 HB01065 Phytochemical platycoside K Platycodon grandiflorum 844.98 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@H](O2)CO)[C@H](O)[C@H](O1)CO)O
1066 HB01066 Phytochemical platycoside G2 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1C(C(C(CO1)O)O)OC1C(C(C(C(O1)C)O)O)O)C)C)C)(CO)CO)OC1C(C(C(C(O1)COC1C(C(C(C(O1)CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O)O)O)O)O)O)O
1067 HB01067 Phytochemical platycoside G1 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1C(C(C(CO1)O)O)OC1C(C(C(C(O1)C)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)CO1)O)O)C)C)C)(CO)CO)OC1C(C(C(C(O1)COC1C(C(C(C(O1)CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)
1068 HB01068 Phytochemical platycoside C Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(OO)[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](OCOCC)[C@@H](O[C@@H]3[C@@H](O)[C@H](O)[C@@H](O)CO3)[C@@H](O2)C)[C@@H](O)[C@@H](O)CO1)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H]
1069 HB01069 Phytochemical platycoside B Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(OO)[C@H]1[C@H](O[C@H]2[C@H](OCOCC)[C@H](O)[C@@H](O[C@@H]3[C@@H](O)[C@H](O)[C@@H](O)CO3)[C@@H](O2)C)[C@@H](O)[C@@H](O)CO1)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H]
1070 HB01070 Phytochemical 16-oxo-platycodin D Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@](C(=O)C2)(CCC(C1)(C)C)C(=O)OC1C(C(C(CO1)O)O)OC1OC(C(C(C1O)O)OC1OCC(C(C1O)OC1OCC(C1O)(CO)O)O)C)C)C)C)(CO)CO)OC1C(C(C(C(O1)CO)O)O)O)O
1071 HB01071 Phytochemical 3-O-beta-D-glucopyranosyl platycodigenin Platycodon grandiflorum 682.84 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O
1072 HB01072 Phytochemical 3'-O-acetylplatycodin D2 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O[C@H]1[C@@H]([C@H]([C@H](CO1)O)O)OC1[C@@H]([C@@H]([C@H]([C@@H](O1)C)OC1OC[C@H]([C@@H]([C@H]1O)OC1OC[C@]([C@H]1O)(O)CO)O)OC(=O)C)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(
1073 HB01073 Phytochemical platycoside F Platycodon grandiflorum 961.09 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)O[C@H]1[C@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@@H](O2)C)[C@@H](O)[C@@H](O)CO1)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O
1074 HB01074 Phytochemical 3-O-beta-D-glucopyranosyl platycodigenin methyl ester Platycodon grandiflorum 696.87 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC)C)C)C)(CO)CO)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O
1075 HB01075 Phytochemical platycodon D Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1(CC([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@](CO1)(CO)O)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1076 HB01076 Phytochemical platycodon D3 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1(CC([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@](CO1)(CO)O)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)COC1[C@@H](C([C@H](C(C1)C
1077 HB01077 Phytochemical deapioplatycodin D Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1078 HB01078 Phytochemical 2'-O-acetylplatycodin D2 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)OC(=O)C)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)OC1[C@@H
1079 HB01079 Phytochemical platycoside A Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1C(C(C(CO1)O)O)OC1C(C(C(C(O1)C)OC1C(C(C(CO1)O)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O)O
1080 HB01080 Phytochemical deapio platycodin D3 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)([C@]2(C(=CC1)C1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1C(C(C(CO1)O)O)OC1C(C(C(C(O1)C)OC1C(C(C(CO1)O)O)O)O)O)C)C)C)(CO)CO)OC1C(C(C(C(O1)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O1)CO)O)O)O)O
1081 HB01081 Phytochemical platycodin A Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)OC(=O)C)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1082 HB01082 Phytochemical Platycogenic acid C Platycodon grandiflorum 504.70 [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@]([C@H](C2)O)(C[C@@H](C(C1)(C)C)O)C(=O)O)C)C)C)(C)C)O)O
1083 HB01083 Phytochemical deapio-platycoside E Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@](C(C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)COC1[C@@H](C([C@H](C(O1)COC1[C@@H](C([C@H](C(O1)C
1084 HB01084 Phytochemical platycodin D2 Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@](C(C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)OC1[C@@H](C([C@H](
1085 HB01085 Phytochemical platycoside E Platycodon grandiflorum, Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C@@](C(C2)O)(CCC(C1)(C)C)C(=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)COC1[C@@H](C([C@H](C(O1
1086 HB01086 Phytochemical platycodin D Platycodon grandiflorum [C@H]1([C@@H](C(C2[C@](C1)(C1[C@@](CC2)(C2(C(=CC1)[C@H]1[C](C(C2)O)(CCC(C1)(C)C)(C=O)OC1[C@@H](C([C@H](CO1)O)O)OC1[C@@H](C([C@H](C(O1)C)OC1[C@@H](C([C@H](CO1)O)OC1[C@@H]([C@@](O)(CO)CO1)O)O)O)O)C)C)C)(CO)CO)OC1[C@@H](C([C@H](C(O1)CO)O)O)O)O
1087 HB01087 Phytochemical Agarotetrol(AH1) Aquilaria agallocha Roxb. 318.32 [C@H]1([C@@H](C(c2c(C1O)oc(cc2=O)CCc1ccccc1)O)O)O
1088 HB01088 Phytochemical Amarasterone B Cyathula capitata (Wall.) Moq. 522.71 [C@H]1([C@@H](C[C@@]2([C@@](C1)(C)C1C(=CC2=O)C2([C@](CC1)([C@H](CC2)[C@@](O)(C(CC(CCO)C(C)C)O)C)C)O)C)O)O
1089 HB01089 Phytochemical Amarasterone A Cyathula capitata (Wall.) Moq. 522.71 [C@H]1([C@@H](C[C@@]2([C@@](C1)(C)C1C(=CC2=O)C2([C@](CC1)([C@H](CC2)[C@](C)(C(CC(CC)C(C)CO)O)O)C)O)C)O)O
1090 HB01090 Phytochemical 5?-Hydroxyecdysterone Polypodium niponicum Mett. 496.63 [C@H]1([C@@H](C[C@@]2([C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@](CC1)([C@H](CC2)[C@@]([C@@H](CCC(O)(C)C)O)(C)O)C)O)C)O)O)O
1091 HB01091 Phytochemical Sengesterone Cyathula capitata (Wall.) Moq. 536.65 [C@H]1([C@@H](C[C@@]2([C@](C1)(C1C(=CC2=O)C2([C@](CC1)([C@H](CC2)C(C)(C(CC1C(C(=O)OC1C)C)O)O)C)O)C)O)O)O
1092 HB01092 Phytochemical polypodine,b Achyranthes bidentata, Achyranthes bidentata 496.63 [C@H]1([C@@H](C[C@@]2(C(C1)(C1C(=CC2=O)[C@]2(C(CC1)(C)C(CC2)[C@](C)([C@@H](CCC(C)(C)O)O)O)O)C)O)O)O
1093 HB01093 Phytochemical Polyporusterone G Polyporus umbellatus 460.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@@H]([C@@H]([C@@H](CC(=C)C(C)C)O)C)CC2)O)C)O)O
1094 HB01094 Phytochemical polyporoid,a Polyporus umbellatus 492.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@@H]1[C@H](C2)O[C@H]([C@@]1(O)C)[C@H](C(C)C(C)C)O)O)C)O)O
1095 HB01095 Phytochemical polyporoid,c Polyporus umbellatus 494.66 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@H]([C@H](C2)O)[C@](O)(C)[C@@H](CC(C(C)C)C)O)O)C)O)O
1096 HB01096 Phytochemical polyporoid,b Polyporus umbellatus 492.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@H](CC2)[C@](O)(C)[C@@H]([C@@H]1OC[C@H]([C@@H]1C)C)O)O)C)O)O
1097 HB01097 Phytochemical polyporusterone,a Polyporus umbellatus 477.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@H](CC2)[C@](O)(C)[C@@H]([CH]C(C(C)C)C)O)O)C)O)O
1098 HB01098 Phytochemical polyporusterone,b Polyporus umbellatus 476.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@H](CC2)[C@](O)(C)[C@@H](CC(=C)C(C)C)O)O)C)O)O
1099 HB01099 Phytochemical polyporusterone,c Polyporus umbellatus 476.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@H](CC2)[C@](O)(C)[C@H]1C(C(C(C)C)C)O1)O)C)O)O
1100 HB01100 Phytochemical polyporusterone,g Polyporus umbellatus 460.65 [C@H]1([C@@H](C[C@@H]2[C@](C1)([C@@H]1C(=CC2=O)[C@]2([C@@](CC1)(C)[C@H](CC2)[C@H](C)[C@@H](CC(=C)C(C)C)O)O)C)O)O

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