Phytochemical database

No Ligand ID Drug Group Generic Name Name of Plant MW Smile Edit
801 HB00801 Phytochemical genkwanine,c Daphne genkwa 652.77 [C@@H]12[C@]([C@@H]([C@@]([C@H]([C@@H]3C41[C@@H](C[C@]1(C3OC(O4)(O1)c1ccccc1)C(=C)C)C)O)(O)CO)O)([C@H]([C@H](C2)C)OC(=O)/C=C/C=C/C=C/CCC)O
802 HB00802 Phytochemical genkwanine,b Daphne genkwa 654.79 [C@@H]12[C@]([C@@H]([C@@]([C@H]([C@@H]3C41[C@@H](C[C@]1(C3OC(O4)(O1)c1ccccc1)C(=C)C)C)O)(O)CO)O)([C@H]([C@H](C2)C)OC(=O)/C=C/C=C/CCCCC)O
803 HB00803 Phytochemical genkwanine,d Daphne genkwa 608.68 [C@@H]12[C@]([C@@H]([C@@]([C@H]([C@@H]3C41[C@@H](C[C@]1(C3OC(O4)(O1)c1ccccc1)C(=C)C)C)O)(O)CO)O)([C@H]([C@H](C2)C)OC(=O)c1ccccc1)O
804 HB00804 Phytochemical Terpenoid EA-1 Excoecaria agallocha 528.63 [C@@H]12[C@]([C@@H]([C@@]3([C@H]([C@@H]4[C@@]51[C@@H](C[C@]1([C@@H]4OC(O5)(O1)/C=C/C=C/CCCCC)C(=C)C)C)O3)CO)O)(C(=O)C(=C2)C)O
805 HB00805 Phytochemical yuanhuagine Daphne genkwa 584.65 [C@@H]12[C@]([C@@H]([C@@]3(C([C@@H]4C51[C@@H]([C@H]([C@]1(C4OC(O5)(O1)/C=C/C=C/C=C/CCC)C(=C)C)OC(=O)C)C)O3)CO)O)(C(=O)C(=C2)C)O
806 HB00806 Phytochemical yuanhuajine Daphne genkwa 660.75 [C@@H]12[C@]([C@@H]([C@@]3(C([C@@H]4C51[C@@H]([C@H]([C@]1(C4OC(O5)(O1)/C=C/C=C/C=C/CCC)C(=C)C)OC(=O)Cc1ccccc1)C)O3)CO)O)(C(=O)C(=C2)C)O
807 HB00807 Phytochemical yuanhuapine Daphne genkwa 542.57 [C@@H]12[C@]([C@@H]([C@@]3(C([C@@H]4C51[C@@H]([C@H]([C@]1(C4OC(O5)(O1)c1ccccc1)C(=C)C)OC(=O)C)C)O3)CO)O)(C(=O)[C@H](C2)C)O
808 HB00808 Phytochemical genkwanine,l Daphne genkwa 560.59 [C@@H]12[C@]([C@@H]([C@]([C@@H]([C@@H]3C41[C@@H]([C@H]([C@]1(C3OC(O4)(O1)c1ccccc1)C(=C)C)OC(=O)C)C)O)(O)CO)O)(C(=O)[C@H](C2)C)O
809 HB00809 Phytochemical 10?-Benzoyloxy-5?-(3'-dimethylamino-3'-phenyl)propanoxy-1?-hydroxy-7?,9?,13?-triacetoxy-11(15?1)-abeo-taxa-4(20),11-dien Taxus brevifolia Nutt. 773.91 [C@@H]12[C@]([C@@H]([C@H](C3=C([C@H](C[C@]3(C1)C(C)(C)O)OC(=O)C)C)OC(=O)c1ccccc1)OC(=O)C)([C@@H](C[C@H](C2=C)OC(=O)C[C@@H](c1ccccc1)N(C)C)OC(=O)C)C
810 HB00810 Phytochemical 10?-Benzoyloxy-1?-hydroxy-5?-(3'-methylamino-3'-phenyl)pro-panexy-7?,9?,13?-triacetoxy-11(15?1)-abeo-taxa-4(20),11-diene Taxus brevifolia Nutt. 759.88 [C@@H]12[C@]([C@@H]([C@H](C3=C([C@H](C[C@]3(C1)C(C)(C)O)OC(=O)C)C)OC(=O)c1ccccc1)OC(=O)C)([C@@H](C[C@H](C2=C)OC(=O)C[C@@H](c1ccccc1)NC)OC(=O)C)C
811 HB00811 Phytochemical Grayanotoxin II Rhododendron molle (Bl.) G. Don 352.47 [C@@H]12[C@]([C@@H](C[C@]34[C@H](C1=C)CC[C@H]([C@H]3O)[C@](C4)(C)O)O)(C([C@H](C2)O)(C)C)O
812 HB00812 Phytochemical 6?-Methyl-2?,6?-dihydroxymethylbicyclo[3.1.1]heptane Urtica dioica L. 170.25 [C@@H]12[C@]([C@@H](CC[C@H]1CO)C2)(C)CO
813 HB00813 Phytochemical Fastigilin B Baileya multiradiata Harv. et Gray 362.42 [C@@H]12[C@]([C@H]([C@H]3[C@@H]([C@@H]([C@H]1C)O)OC(=O)[C@H]3C)OC(=O)C=C(C)C)(C(=O)C=C2)C
814 HB00814 Phytochemical Fastigilin C Baileya multiradiata Harv. et Gray 360.40 [C@@H]12[C@]([C@H]([C@H]3[C@@H]([C@@H]([C@H]1C)O)OC(=O)C3=C)OC(=O)C=C(C)C)(C(=O)C=C2)C
815 HB00815 Phytochemical Arnicolide A Arnica montana 306.35 [C@@H]12[C@]([C@H]([C@H]3[C@@H](C[C@H]1C)OC(=O)[C@@H]3C)OC(=O)C)(C(=O)C=C2)C
816 HB00816 Phytochemical Plenolin Baileya pleniradiata, Helenium autumnale 264.32 [C@@H]12[C@]([C@H]([C@H]3[C@@H](C[C@H]1C)OC(=O)[C@H]3C)O)(C(=O)C=C2)C
817 HB00817 Phytochemical Psilostachyin C Ambrosia psilostachya, Ambrosia artemisllfolia L. 264.32 [C@@H]12[C@]([C@H]3[C@@H](CC[C@@H]1C)C(=C)C(=O)O3)(OC(=O)CC2)C
818 HB00818 Phytochemical Buergerinin C Scrophularia ningpoensis 228.24 [C@@H]12[C@](C(=C[C@H]1OC)CO)(CO)COC(=O)C2
819 HB00819 Phytochemical Paucin Agastache rugosa (Fisch. et Mey.) O. Ktze., Baileya pleniradiata, Nardostachys jatamansi, Pogostemon cablin, Baileya multiradiata Harv. et Gray, Nardostachys chinensis Batal., Baileya pauciradiata 468.49 [C@@H]12[C@](C[C@H]3[C@@H](C[C@H]1C)OC(=O)C3=C)(C(=O)C[C@@H]2O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)COC(=O)C)O)O)O)C
820 HB00820 Phytochemical Aromaticin Helenium aromaticum, Helenium amarum, Helenium amarum 246.30 [C@@H]12[C@](C[C@H]3[C@H](C[C@H]1C)OC(=O)C3=C)(C(=O)C=C2)C
821 HB00821 Phytochemical Procurcumadiol Curcuma longa 250.33 [C@@H]12[C@](CC(=C(C)C)C(=O)C=C1C)([C@](CC2)(O)C)O
822 HB00822 Phytochemical Diterpenoid EF-D Atractylodes lancea (Thunb.) DC. 474.59 [C@@H]12[C@](CC(=C[C@@H]3[C@@]1([C@@H](C[C@@]1([C@H]3C1(C)C)OC(=O)C(CC)C)C)O)COC(=O)C)(C(=O)C(=C2)C)O
823 HB00823 Phytochemical 12-O-Palmitoyl-16-hydroxyphorbol Elaeis guineensis 506.59 [C@@H]12[C@](CC(=C[C@@H]3[C@@]1([C@H]([C@H]([C@@]1([C@H]3[C@@]1(C)CO)OC(=O)C)OC(=O)CCCC)C)O)CO)(C(=O)C(=C2)C)O
824 HB00824 Phytochemical 12-O-Acetylphorbla-13-decanoate Croton tiglium 544.72 [C@@H]12[C@](CC(=C[C@@H]3[C@H]1[C@@H]([C@H]([C@@]1([C@H]3C1(C)C)OC(=O)CCCCCCCCC)OC(=O)C)C)CO)(C(=O)C(=C2)C)O
825 HB00825 Phytochemical 13-O-acetylphorbol-20-linoleate Croton tiglium 668.90 [C@@H]12[C@](CC(=CC3[C@@]1([C@@H]([C@H]([C@@]1([C@H]3C1(C)C)OC(=O)C)O)C)O)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(C(=O)C(=C2)C)O
826 HB00826 Phytochemical 23-Hydroxy-3?-[(O-?-L-rhamnopyranosyl-(1?2)-O-[?-D-glucopyranosyl-(1?4)]-?-L-arabinopyranosyl)oxy]lup-20(29)-en-28-oic acid 28-O-?-L-rhamnopyranosyl-(1?4)-O-?-D-glucopyranosyl-(1?6)-?-D-glucopyranosyl ester Pulsatilla chinensis [C@@H]12[C@](CC[C@H]1C(=C)C)(CC[C@@]1([C@@H]2CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(CC[C@@H]([C@@]1(C)CO)O[C@H]1[C@@H]([C@H]([C@H](CO1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)C)C)C)C(=O)O[C@H]1[C@@H]([C@H]([C@@H]
827 HB00827 Phytochemical 23-Hydroxy-3?-[(O-?-L-rhamnopyranosyl-(1?2)-O-[O-?-D-glucopyranosyl-(1?4)-?-D-glucopyranosyl-(1?4)]-?-L-arabinopyranosyl) oxy]lup-20(29)-en-28-oic acid 28-O-?-L-rhamnopyranosyl-(1?4)-O-?-D-glucopyranosyl-(1?6)-?-D-glucopyranosyl ester Pulsatilla chinensis 934.09 [C@@H]12[C@](CC[C@H]1C(=C)C)(CC[C@@]1([C@@H]2CC[C@H]2[C@]1(CC[C@@H]1[C@@]2(CC[C@@H]([C@@]1(C)CO)O[C@H]1[C@@H]([C@H]([C@H](CO1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)
828 HB00828 Phytochemical Corynoloxine Corydalis incisa (Thunb.) Pers. 365.38 [C@@H]12[C@]3([C@@H](c4c(C1)cc1c(c4)OCO1)N([C@H](c1c3ccc3c1OCO3)O2)C)C
829 HB00829 Phytochemical Arteannuin G Artemisia annua L. 282.33 [C@@H]12[C@]3([C@@H](CC[C@H]1C)[C@H](C(=O)O[C@@H]3OC(=O)C)C)OCC2
830 HB00830 Phytochemical Huperzine B Huperzia serrata (Thunb.) Trev. 256.34 [C@@H]12[C@]3(c4c(C[C@@H]1C=C(C3)C)[nH]c(=O)cc4)NCCC2
831 HB00831 Phytochemical 4-epi-curcumenol Curcuma wenyujin 234.33 [C@@H]12[C@]3(CC(=C(C)C)[C@](C=C1C)(O)O3)[C@@H](CC2)C
832 HB00832 Phytochemical 4-Epicurcumenol Curcuma zedoaria (Berg.) Rose. 234.33 [C@@H]12[C@]3(CC(=C(C)C)[C@](C=C1C)(O3)O)[C@@H](CC2)C
833 HB00833 Phytochemical 6,6-Dimethyl-spiro[bicyclo[3 Ligusticum chuanxiong 152.23 [C@@H]12[C@]3(CC[C@@H](C1(C)C)C2)OC3
834 HB00834 Phytochemical lismol Alisma orientalis 254.37 [C@@H]12[C@H]([C@@H]([C@@]3(CC[C@@]1(C)O3)C(C)C)O)[C@](CC2)(O)C
835 HB00835 Phytochemical L-Picropodophyllin 7'-O-?-D-glucopyranoside Podophyllum emodll 576.55 [C@@H]12[C@H]([C@@H](c3c([C@@H]1O[C@@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O)cc1c(c3)OCO1)c1cc(c(c(c1)OC)OC)OC)C(=O)OC2
836 HB00836 Phytochemical Picropodophyllone Juniperus sabina, Podophyllum emodll, Diphylleia sinensis Li 412.39 [C@@H]12[C@H]([C@@H](c3c(C1=O)cc1c(c3)OCO1)c1cc(c(c(c1)OC)OC)OC)C(=O)OC2
837 HB00837 Phytochemical Mexicanin I Helenium autumnale 248.27 [C@@H]12[C@H]([C@H]([C@H]3[C@H](C[C@H]1C)OC(=O)C3=C)O)C(=O)C=C2
838 HB00838 Phytochemical aromadendrane-7beta,11alpha-diol Panax notoginseng, Panax notoginseng 238.37 [C@@H]12[C@H]([C@H]3[C@@H](CC[C@@]1(C)O)C3(C)C)[C@@](CC2)(O)C
839 HB00839 Phytochemical aromadendrane-7alpha,11alpha-diol Panax notoginseng, Panax notoginseng 238.37 [C@@H]12[C@H]([C@H]3[C@@H](CC[C@@]1(C)O)C3(C)C)[C@](CC2)(O)C
840 HB00840 Phytochemical aromadendrene Angelica sinensis, Atractylodes macrocephala Koidz., Descurainia sophia, Platycladus orientalis 204.35 [C@@H]12[C@H]([C@H]3[C@@H](CCC1=C)C3(C)C)[C@@H](CC2)C
841 HB00841 Phytochemical spathulenol Angelica sinensis, Panax notoginseng, Atractylodes macrocephala Koidz., Artemisia scoparia, Houttuynia cordata, Artemisia annua, Zanthoxylum schinifolium, Citrus medica L, Ligusticum chuanxiong, Cyperus rotundus L, Panax notoginseng 220.35 [C@@H]12[C@H](C(=C)CCC3C1C3(C)C)CC[C@]2(C)O
842 HB00842 Phytochemical alismoxide Alisma orientalis, Alisma orientalis 238.37 [C@@H]12[C@H](C=C(CC[C@]1(O)C)C(C)C)[C@](CC2)(O)C
843 HB00843 Phytochemical Euphorbia factor Ti2 Euphorbia tirucalli 538.67 [C@@H]12[C@H](CC(=C[C@@H]3[C@]1([C@@H]([C@H]([C@@]1([C@H]3C1(C)C)OC(=O)/C=C\C=C\C=C\CCC)OC(=O)C)C)O)CO)C(=O)C(=C2)C
844 HB00844 Phytochemical Erycibelline Erycibe elliptilimba Merr. et Chun 143.18 [C@@H]12[C@H](CCC(C[C@H]1O)N2)O
845 HB00845 Phytochemical ?-Copaene Angelica pubescens, Artemisia annua, Bupleurum scorzonerifolium Willd., Zingiber officinale, Humulus japonicus, Artemisia annua L., Panax notoginseng 204.35 [C@@H]12[C@H]3[C@@H](CC[C@@]1([C@H]3C(=CC2)C)C)C(C)C
846 HB00846 Phytochemical dimeric sulfur-containing iridoid glucoside-2 Paederia scandens 892.85 [C@@H]12[C@H]3[C@H](OC=C1C(=O)O[C@H]2C=C3COC(=O)SC)O[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1OC(=O)C1=CO[C@@H]([C@@H]2[C@H]1[C@H](C=C2COC(=O)SC)O)O[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)CO)O)O)CO
847 HB00847 Phytochemical Buergerinin E Scrophularia ningpoensis 216.23 [C@@H]12[C@H]3[C@H](OCC1)OC[C@@]3([C@@H]([C@H]2OC)O)O
848 HB00848 Phytochemical Spectabiline Crotalaria retusa 367.39 [C@@H]12[C@H]3CCN1CC=C2COC(=O)[C@@]([C@]([C@H](C(=O)O3)C)(OC(=O)C)C)(O)C
849 HB00849 Phytochemical 2?-Hydroxy-2?-hydroxymethyl-6,6-dimethyl bicyclo[3.1.1]heptane-2?-O-glucoside Urtica dioica L. 332.39 [C@@H]12C([C@@H](CC[C@]1(CO[C@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)C2)(C)C
850 HB00850 Phytochemical 10-Acetoxymajoroside Plantago major L. 446.40 [C@@H]12C(=C([C@H](C2)O)COC(=O)C)[C@@H](OC=C1C(=O)OC)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO
851 HB00851 Phytochemical orientalol,f Alisma orientalis 236.35 [C@@H]12C(=C(CC2)C)[C@@H]([C@@]2(CC[C@]1(O2)C)C(C)C)O
852 HB00852 Phytochemical pinocarvone Artemisia annua, Zanthoxylum schinifolium, Cyperus rotundus L 150.22 [C@@H]12C(=C)C(=O)C[C@@H](C1)C2(C)C
853 HB00853 Phytochemical 2,6-Dimethyl-6-(4-methyl-3-pentenyl)-bicyclo[3 Citrus medica L, Artemisia capillaries, Zanthoxylum schinifolium, Ligusticum chuanxiong, Santalum album 204.35 [C@@H]12C(=CC[C@@H]([C@@]1(CCC=C(C)C)C)C2)C
854 HB00854 Phytochemical 5-(1-Methylethyl)-bicyclo[3 Ligusticum chuanxiong 138.21 [C@@H]12C(=O)CC[C@@]1(C2)C(C)C
855 HB00855 Phytochemical L-Prolyl-L-proline anhydride Pinellia pedatisecta Schott 194.23 [C@@H]12C(=O)N3[C@H](C(=O)N1CCC2)CCC3
856 HB00856 Phytochemical Buergerinin G Scrophularia ningpoensis 184.19 [C@@H]12C[C@@]3(OCC[C@]1(O3)CC(=O)O2)C
857 HB00857 Phytochemical Buergerinin F Scrophularia ningpoensis 170.21 [C@@H]12C[C@@]3(OCC[C@]1(O3)CCO2)C
858 HB00858 Phytochemical 10-Epiatractyloside A Atractylodes japonica, Atractylodes lancea (Thunb.) DC. 448.51 [C@@H]12C[C@@H](CC[C@]([C@H]1CC(=O)[C@@]2(C)O)(CO)O)C(C)(C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
859 HB00859 Phytochemical ?-Bergamotene Angelica pubescens, Daucus carota L., Artemisia capillaries, Zingiber officinale, Echinops grijsii Hance, Perilla frutescens (L.) Britt. var. acuta (Thunb.) Kudo 204.35 [C@@H]12C[C@@H](CC=C1C)[C@@]2(C)CCC=C(C)C
860 HB00860 Phytochemical Pteropodic acid Uncaria sinensis 354.40 [C@@H]12C[C@H]3[C@@H](CN1CC[C@@]12C(=O)Nc2c1cccc2)[C@@H](OC=C3C(=O)O)C
861 HB00861 Phytochemical Caracurine V Strychnos dolichothyrsa, Strychnos afzelii 584.75 [C@@H]12C[C@H]3[C@]45[C@@H]6[C@@H]1[C@@H](OCC=C2CN3CC5)N1[C@@H]2[C@@]3([C@@H]5C[C@@H]7[C@H]2[C@H](N6c2c4cccc2)OCC=C7CN5CC3)c2c1cccc2
862 HB00862 Phytochemical 4,4,6,6-tetramethyl-bicyclo[3 Houttuynia cordata 136.23 [C@@H]12C=CC([C@@H]1C2(C)C)(C)C
863 HB00863 Phytochemical Ambrosin Hymenoclea salsola, Ambrosia maritima, Ambrosia maritima 246.30 [C@@H]12C=CC(=O)[C@@]1(C)[C@H]1[C@@H](CC[C@@H]2C)C(=C)C(=O)O1
864 HB00864 Phytochemical Jacobine Senecio jacobaea, Senecio jacobaea, Senecio cineraria, Senecio cineraria, Senecio alpinus 351.39 [C@@H]12C3=CCN2CC[C@H]1OC(=O)[C@]1(C[C@H]([C@](C(=O)OC3)(O)C)C)[C@@H](O1)C
865 HB00865 Phytochemical Cularimine Dicentra eximia 327.37 [C@@H]12c3c(Oc4c(C1)cc(c(c4)OC)OC)c(ccc3CCN2)OC
866 HB00866 Phytochemical Cularidine Dicentra cucullaria 327.37 [C@@H]12c3c(Oc4c(C1)cc(c(c4)OC)OC)c(ccc3CCN2C)O
867 HB00867 Phytochemical Cularine Dicentra eximia, Dicentra cucullaria 341.40 [C@@H]12c3c(Oc4c(C1)cc(c(c4)OC)OC)c(ccc3CCN2C)OC
868 HB00868 Phytochemical phyllocladene Boswellia carterii 272.47 [C@@H]12CC[C@@H]3C(CC1=C)(CC[C@H]1[C@]3(CCCC1(C)C)C)C2
869 HB00869 Phytochemical bicyclo [3 Cyperus rotundus L 94.15 [C@@H]12CCC[C@@H]1C=C2
870 HB00870 Phytochemical Senlciphylline Senecio oryzetorum Diels, Senecio chrysanthemoides DC. 361.43 [C@@H]12CCN3C1C(=CC3)COC(=O)[C@](C(=C)CCC(/C=C\C)C(=O)O2)(C)O
871 HB00871 Phytochemical Cyclo-(Ala-Pro) Psammosilene tunicoides W.C.Wu et C.Y.Wu, Pinellia pedatisecta Schott, Panax notoginseng 168.19 [C@@H]12N(C(=O)[C@@H](NC1=O)C)CCC2
872 HB00872 Phytochemical Daechu alkaloid A Ziziphus jujuba Mill. var. inermis (Bge.) Rehd. 179.22 [C@@H]12N(C3=C(CO1)CCC3=O)CCC2
873 HB00873 Phytochemical limonin,diosphenol Dictamnus dasycarpus 484.50 [C@@H]12OC(C3=C(C(=O)[C@@]4(C([C@@]13COC(=O)C2)CC[C@@]1([C@@]24[C@@H](C(=O)O[C@H]1c1cocc1)O2)C)C)O)(C)C
874 HB00874 Phytochemical (4S,8S)-8,9-Dihydroxy-8,9-dihydrocarvone Anethum graveolens L. 184.23 [C@]([C@@H]1CC(=O)C(=CC1)C)(O)(CO)C
875 HB00875 Phytochemical bruceaketolic,acid Brucea javanica 500.49 [C@]1([C@@H](C[C@@H]2[C@]34[C@@H]1[C@H]([C@@H]([C@@]([C@@H]3[C@H](C(=O)O2)OC(=O)C)(C(=O)OC)OC4)O)O)COCC)(CC(=O)O)C
876 HB00876 Phytochemical Kadsuric acid Schisandra henryi 470.68 [C@]1([C@@H](CC[C@@H]2C1=CC[C@]1([C@]2(CC[C@@H]1[C@@H](CC/C=C(\C(=O)O)/C)C)C)C)C(=C)C)(CCC(=O)O)C
877 HB00877 Phytochemical 8,10-Diacetoxy-2-methoxy-3,11(13)-guaiadiene-12,6-olide Chrysanthemum boreale Mak. 378.42 [C@]1([C@@H]2[C@H]([C@@H]3[C@@H]([C@H](C1)OC(=O)C)C(=C)C(=O)O3)C(=C[C@@H]2OC)C)(OC(=O)C)C
878 HB00878 Phytochemical Dehyfroandrographolide Andrographis paniculata 332.43 [C@]1([C@@H]2C(CCC1O)(C(C(=C)CC2)/C=C/C1=CCOC1=O)C)(CO)C
879 HB00879 Phytochemical Thujanol-4 Thymus vulgaris L. 154.25 [C@]1([C@@H]2CC2(CC1)C(C)C)(O)C
880 HB00880 Phytochemical Aplopaeonoside Paeonia suffruticosa 460.43 [C@]1([C@H]([C@@H](OC1)OCC1[C@H]([C@H]([C@H]([C@@H](O1)Oc1cc(ccc1C(=O)C)OC)O)O)O)O)(CO)O
881 HB00881 Phytochemical piperkadsin C Piper kadsura 340.37 [C@]1([C@H](O)c2cc3OCOc3cc2)(C)C2C(=C1C=C(C2=O)CC=C)OC
882 HB00882 Phytochemical Isohumulone B Humulus lupulus L. 362.46 [C@]1(C(=C(C(=O)[C@@H]1CC=C(C)C)C(=O)CC(C)C)O)(C(=O)CC=C(C)C)O
883 HB00883 Phytochemical Isoshyobunone Acarus calamus L. 220.35 [C@]1(C(=C(C)C)C(=O)[C@@H](CC1)C(C)C)(C=C)C
884 HB00884 Phytochemical Prehumulone Humulus lupulus L. 376.49 [C@]1(C(=O)[C@@H](CC=C(C)C)C(=O)C(=C1O)C(=O)CCC(C)C)(CC=C(C)C)O
885 HB00885 Phytochemical Brasiliensophyllic acid C Calophyllum brasiliense 574.75 [C@]1(C(=O)C(=C2C(=C([C@H]([C@H](O2)C)C)O)C1=O)[C@@H](CC(=O)O)c1ccccc1)(CC=C(C)C)C[C@@H](C=C(C)C)CCC(=C)C
886 HB00886 Phytochemical Brasiliensophyllic acid A Calophyllum brasiliense 560.72 [C@]1(C(=O)C(=C2C(=C([C@H]([C@H](O2)C)C)O)C1=O)[C@@H](CC(=O)O)c1ccccc1)(CC=C(C)C)C[C@H]1C[C@H](C1(C)C)C(=C)C
887 HB00887 Phytochemical Shyobunone Acarus calamus L. 220.35 [C@]1(C(C(=O)C(CC1)C(C)C)C(=C)C)(C=C)C
888 HB00888 Phytochemical trans-1-methyl-4-(1-methylethenyl)-2-cyclohexen-1-ol Citrus reticulata 152.23 [C@]1(C=C[C@@H](CC1)C(=C)C)(O)C
889 HB00889 Phytochemical trans-1-methyl-4-(1-methylethyl)-2-cyclohexen-1-ol Ligusticum chuanxiong, Citrus reticulata 154.25 [C@]1(C=C[C@@H](CC1)C(C)C)(O)C
890 HB00890 Phytochemical cis-1-methyl-4-(1-methylethyl)-,,2-cyclohexen-1-ol Ligusticum chuanxiong, Citrus reticulata 154.25 [C@]1(C=C[C@H](CC1)C(C)C)(O)C
891 HB00891 Phytochemical Artabsin Artemisia absinthium, Artemisia absinthium, Artemisia sieversiana Ehrh. ex Willd. 248.32 [C@]1(C2=CCC(=C2C2C(CC1)[C@@H](C(=O)O2)C)C)(C)O
892 HB00892 Phytochemical ziyuglycoside,i Sanguisorba officinalis 766.96 [C@]1(C2C(CCC1C)(CCC1(C2=CCC2[C@]1(CCC1[C@@]2(CCC(C1(C)C)OC1OC[C@H]([C@H]([C@H]1O)O)O)C)C)C)C(=O)OC1[C@@H]([C@H]([C@@H](C(CO)O1)O)O)O)(O)C
893 HB00893 Phytochemical cis-belta-Terpineol Ephedra sinica, Bupleurum scorzonerifolium Willd., Rosmarinus officinalis L. 154.25 [C@]1(CC[C@@H](CC1)C(=C)C)(O)C
894 HB00894 Phytochemical saikosaponin,v Bupleurum scorzonerifolium, Bupleurum chinense [C@]1(CC[C@]2(C(=C3[C@@](C[C@H]2O)([C@]2(C(C=C3)[C@@]3(C(CC2)[C@]([C@H](CC3)OC2O[C@@H]([C@@H]([C@@H]([C@H]2O)OC2O[C@@H]([C@H]([C@@H]([C@H]2O)O)O)CO)O)C)(C)CO)C)C)C)C1)CO)(C(=O)OCC1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)OCC(C(O)C(O)CO)O)C
895 HB00895 Phytochemical Maytanbutacine Maytenus serrata 707.21 [C@]12([C@@H](/C=C/C=C(/C(c3cc(c(c(c3)OC)Cl)N(C)CC(=O)C[C@H]([C@]3([C@@H]([C@@H]([C@@H](OC(=O)N1)C2)C)O3)C)OC(=O)C(C)C)OC(=O)C)\C)OC)O
896 HB00896 Phytochemical Maytanbutine Maytenus ovatus, Maytenus ovatus, Maytenus serrata, Maytenus serrata, Maytenus buchananll 720.25 [C@]12([C@@H](/C=C/C=C(/Cc3cc(c(c(c3)OC)Cl)N(C)C(=O)C[C@@H]([C@]3([C@@H]([C@@H]([C@@H](OC(=O)N1)C2)C)O3)C)OC(=O)[C@@H](N(C)C(=O)C(C)C)C)\C)OC)O
897 HB00897 Phytochemical 10-Epieupatoroxin Eupatorium rotundifolium 404.45 [C@]12([C@@H]([C@@H]3[C@@]([C@@]1([C@@H]1[C@@H]([C@@H](C[C@]42CO4)OC(=O)/C(=C\C)/C)C(=C)C(=O)O1)O)(C)O3)C)C
898 HB00898 Phytochemical Buergerinin B Scrophularia ningpoensis 202.20 [C@]12([C@@H]([C@](C[C@H]1O)(O)C)COC(=O)C2)O
899 HB00899 Phytochemical (+)-1-Hydroxypinoresinol-4'-O-?-D-glucopyranoside Valeriana officinalis L., Eucommia ulmoides 536.53 [C@]12([C@@H]([C@H](OC1)c1cc(c(cc1)O)OC)CO[C@@H]2c1cc(c(cc1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)OC)O
900 HB00900 Phytochemical 6-Methyl-7-(3-oxobutyl)-bicyclo[4.1.0]heptan-3-one Curcuma longa 194.27 [C@]12([C@@H](CC(=O)CC1)[C@@H]2CCC(=O)C)C

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