Ingredient ID: NPC86469
Formula: C20H19NO5
Common Name | Protopine |
IUPAC Name | n.a. |
Canonical SMILES | CN1CCc2cc3OCOc3cc2C(=O)Cc2c(C1)cc1OCOc1c2 |
Standard InCHI | InChI=1S/C20H19NO5/c1-21-3-2-12-5-17-20(26-11-23-17)8-15(12)16(22)4-13-6-18-19(25-10-24-18)7-14(13)9-21/h5-8H,2-4,9-11H2,1H3 |
Standard InCHIKey | ZAALQOFZFANFTF-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 185559 ZINC ID: ZINC000031502517 ChEMBL ID: CHEMBL486179 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC86469] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Chelidonium majus | Chelidonium | Papaveraceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Corydalis decumbens | Corydalis | Papaveraceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Corydalis ternata | Corydalis | Papaveraceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Nandina domestica | Nandina | Berberidaceae | |
Corydalis remota | Corydalis | Papaveraceae | |
Panax ginseng | Panax | Araliaceae | |
Corydalis rhizoma | Corydalis | Papaveraceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Argemone mexicana | Argemone | Papaveraceae | |
Cephalocroton cordofanus | Cephalocroton | Euphorbiaceae | |
Ziziphus jujuba | Ziziphus | Rhamnaceae | |
Toddalia asiatica | Toddalia | Rutaceae | |
Corydalis yanhusuo | Corydalis | Papaveraceae | |
Papaver somniferum | Papaver | Papaveraceae |
Ingredient ID: NPC81218
Formula: C20H23NO4.HI
Common Name | n.a. |
IUPAC Name | (6aS)-11-hydroxy-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-6-ium-1-olate;hydroiodide |
Canonical SMILES | COc1cc2CC[N+]([C@@H]3c2c(c1[O-])c1c(C3)ccc(c1O)OC)(C)C.I |
Standard InCHI | InChI=1S/C20H23NO4.HI/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18;/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23);1H/t13-;/m0./s1 |
Standard InCHIKey | ODRHNGNRVVELAJ-ZOWNYOTGSA-N |
Ingredient External Links |
PubChem CID: 6451920; 131664584 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC81218] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Magnolia obovata | Magnolia | Magnoliaceae | |
Caltha palustris | Caltha | Ranunculaceae | |
Sinomenium acutum | Sinomenium | Menispermaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Aristolochia contorta | Aristolochia | Aristolochiaceae | |
Magnolia denudata | Magnolia | Magnoliaceae | |
Aristolochia heterophylla | Aristolochia | Aristolochiaceae | |
Berberis amurensis | Berberis | Berberidaceae | |
Aristolochia manshuriensis | Aristolochia | Aristolochiaceae | |
Berberis thunbergii | Berberis | Berberidaceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Phellodendron chinense | Phellodendron | Rutaceae | |
Coptis deltoidea | Coptis | Ranunculaceae | |
Coptis teetoides | Coptis | Ranunculaceae | |
Phellodendron amurense | Phellodendron | Rutaceae | |
Aristolochia debilis | Aristolochia | Aristolochiaceae | |
Magnolia sprengeri | Magnolia | Magnoliaceae | |
Croton cumingii | Croton | Euphorbiaceae | |
Litsea cubeba | Litsea | Lauraceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Epimedium brevicornum | Epimedium | Berberidaceae | |
Magnolia officinalis | Magnolia | Magnoliaceae | |
Coptis chinensis | Coptis | Ranunculaceae |
Ingredient ID: NPC67978
Formula: C21H23NO5
Common Name | Allocryptopine |
IUPAC Name | n.a. |
Canonical SMILES | COc1c(OC)ccc2c1CN(C)CCc1c(C(=O)C2)cc2c(c1)OCO2 |
Standard InCHI | InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22/h4-5,9-10H,6-8,11-12H2,1-3H3 |
Standard InCHIKey | HYBRYAPKQCZIAE-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 98570 ZINC ID: ZINC000019204597 ChEMBL ID: CHEMBL520043 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC67978] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Artabotrys maingayi | Artabotrys | Annonaceae | |
Chelidonium majus | Chelidonium | Papaveraceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Erythrophleum suaveolens | Erythrophleum | Fabaceae | |
Corydalis turtschaninovii | Corydalis | Papaveraceae | |
Corydalis decumbens | Corydalis | Papaveraceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Thuja plicata | Thuja | Cupressaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Cyperus nipponicus | Cyperus | Cyperaceae | |
Larix decidua | Larix | Pinaceae | |
Macleaya cordata | Macleaya | Papaveraceae | |
Dendrobium amplum | Dendrobium | Orchidaceae | |
Dalbergia spruceana | Dalbergia | Fabaceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Garcinia xanthochymus | Garcinia | Clusiaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Nuxia sphaerocephala | Nuxia | Stilbaceae | |
Hylomecon japonica | Hylomecon | Papaveraceae | |
Senna spectabilis | Senna | Fabaceae | |
Horsfieldia glabra | Horsfieldia | Myristicaceae | |
Symphytum officinale | Symphytum | Boraginaceae | |
Psacalium peltatum | Psacalium | Asteraceae | |
Diospyros ebenum | Diospyros | Ebenaceae | |
Angelica dahurica | Angelica | Apiaceae | |
Corydalis ophiocarpa | Corydalis | Papaveraceae | |
Corydalis ternata | Corydalis | Papaveraceae | |
Teclea sudanica | Teclea | Rutaceae | |
Mezzettia leptopoda | Mezzettia | Annonaceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Stachys plumosa | Stachys | Lamiaceae | |
Piper methysticum | Piper | Piperaceae | |
Lappula echinata | Lappula | Boraginaceae | |
Ligularia sagitta | Ligularia | Asteraceae | |
Corydalis remota | Corydalis | Papaveraceae | |
Ulex airensis | Ulex | Fabaceae | |
Prunus humilis | Prunus | Rosaceae | |
Corydalis rhizoma | Corydalis | Papaveraceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Chaetomorpha moniligera | Chaetomorpha | Cladophoraceae | |
Argemone mexicana | Argemone | Papaveraceae | |
Corydalis yanhusuo | Corydalis | Papaveraceae | |
Swertia mussotii | Swertia | Gentianaceae | |
Zanthoxylum nitidum | Zanthoxylum | Rutaceae |
Ingredient ID: NPC49075
Formula: C37H40N2O6
Common Name | Berbamine |
IUPAC Name | n.a. |
Canonical SMILES | COc1c(OC)cc2c3c1Oc1cc4c(cc1OC)CCN([C@H]4Cc1ccc(Oc4cc(C[C@H]3N(CC2)C)ccc4O)cc1)C |
Standard InCHI | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-31-18-23(8-11-30(31)40)17-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m0/s1 |
Standard InCHIKey | DFOCUWZXJBAUSQ-URLMMPGGSA-N |
Ingredient External Links |
PubChem CID: 275182 ZINC ID: ZINC000030726840 ChEMBL ID: CHEMBL504323 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC49075] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Chrysanthemum myconis | Chrysanthemum | Asteraceae | |
Acnistus arborescens | Acnistus | Solanaceae | |
Berberis fortunei | Berberis | Berberidaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Dunaliella salina | Dunaliella | Dunaliellaceae | |
Garcinia paucinervis | Garcinia | Clusiaceae | |
Sphaerophysa salsula | Sphaerophysa | Fabaceae | |
Berberis thunbergii | Berberis | Berberidaceae | |
Euphorbia characias subsp. wulfenii | Euphorbia | Euphorbiaceae | |
Doronicum grandiflorum | Doronicum | Asteraceae | |
Panax quinquefolius | Panax | Araliaceae | |
Oxytropis lanata | Oxytropis | Fabaceae | |
Populus balsamifera | Populus | Salicaceae | |
Pilosocereus chrysacanthus | Pilosocereus | Cactaceae | |
Strychnos gossweileri | Strychnos | Loganiaceae | |
Hylomecon japonica | Hylomecon | Papaveraceae | |
Leibnitzia anandria | Leibnitzia | Asteraceae | |
Lithocarpus haipinii | Lithocarpus | Fagaceae | |
Notholaena schaffneri | Notholaena | Pteridaceae | |
Plectranthus ernstii | Plectranthus | Lamiaceae | |
Eupatorium glandulosum | Eupatorium | Asteraceae | |
Sideritis ferrensis | Sideritis | Lamiaceae | |
Radula voluta | Radula | Radulaceae | |
Euphorbia broteri | Euphorbia | Euphorbiaceae | |
Zamia spiralis | Zamia | Zamiaceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Stephania cepharantha | Stephania | Menispermaceae | |
Cyclea barbata | Cyclea | Menispermaceae | |
Piper retrofractum | Piper | Piperaceae | |
Ardisia hortorum | Ardisia | Primulaceae | |
Artocarpus incisa | Artocarpus | Moraceae | |
Ligularia nelumbifolia | Ligularia | Asteraceae | |
Berberis oblonga | Berberis | Berberidaceae |
Ingredient ID: NPC317145
Formula: C38H42N2O6
Common Name | n.a. |
IUPAC Name | n.a. |
Canonical SMILES | COc1c(OC)cc2c3c1Oc1cc4c(cc1OC)CCN(C4Cc1ccc(Oc4cc(CC3N(CC2)C)ccc4OC)cc1)C |
Standard InCHI | InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3 |
Standard InCHIKey | WVTKBKWTSCPRNU-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 5422 ChEMBL ID: CHEMBL367260 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC317145] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Stephania tetrandra | Stephania | Menispermaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Cissampelos pareira | Cissampelos | Menispermaceae | |
Aristolochia heterophylla | Aristolochia | Aristolochiaceae | |
Berberis thunbergii | Berberis | Berberidaceae | |
Astragalus membranaceus | Astragalus | Fabaceae | |
Aristolochia debilis | Aristolochia | Aristolochiaceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Stephania cepharantha | Stephania | Menispermaceae |
Ingredient ID: NPC303581
Formula: C21H23NO5
Common Name | n.a. |
IUPAC Name | n.a. |
Canonical SMILES | COc1cc2C(=O)Cc3ccc4c(c3CN(CCc2cc1OC)C)OCO4 |
Standard InCHI | InChI=1S/C21H23NO5/c1-22-7-6-14-9-19(24-2)20(25-3)10-15(14)17(23)8-13-4-5-18-21(16(13)11-22)27-12-26-18/h4-5,9-10H,6-8,11-12H2,1-3H3 |
Standard InCHIKey | XPOJSWHIKCNLEQ-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 72616 ZINC ID: ZINC000019632726 ChEMBL ID: CHEMBL1339015 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC303581] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Chrozophora prostrata | Chrozophora | Euphorbiaceae | |
Chelidonium majus | Chelidonium | Papaveraceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Hylomecon japonica | Hylomecon | Papaveraceae | |
Aloe microstigma | Aloe | Asphodelaceae | |
Corydalis pallida | Corydalis | Papaveraceae | |
Corydalis rhizoma | Corydalis | Papaveraceae | |
Dicentra spectabilis | Dicentra | Papaveraceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Papaver sommiferum | Papaver | Papaveraceae | |
Argemone mexicana | Argemone | Papaveraceae | |
Papaver somniferum | Papaver | Papaveraceae |
Ingredient ID: NPC271013
Formula: C37H40N2O6
Common Name | Homoaromoline |
IUPAC Name | n.a. |
Canonical SMILES | COc1cc2CCN([C@H]3c2cc1Oc1c2c(CCN([C@H]2Cc2ccc(Oc4cc(C3)ccc4OC)cc2)C)cc(c1O)OC)C |
Standard InCHI | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-31(42-4)33-21-27(24)28(38)17-23-8-11-30(41-3)32(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(43-5)36(40)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m1/s1 |
Standard InCHIKey | YJRWQNIRFXVBRB-WDYNHAJCSA-N |
Ingredient External Links |
PubChem CID: 99620 ZINC ID: ZINC000042851784 ChEMBL ID: CHEMBL509855 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC271013] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Coleonema pulchellum | Coleonema | Rutaceae | |
Tamarix chinensis | Tamarix | Tamaricaceae | |
Stephania epigaea | Stephania | Menispermaceae | |
Stephania erecta | Stephania | Menispermaceae | |
Citrus yuko | Citrus | Rutaceae | |
Magnolia ovata | Magnolia | Magnoliaceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Stephania cepharantha | Stephania | Menispermaceae | |
Cyclea barbata | Cyclea | Menispermaceae | |
Thalictrum lucidum | Thalictrum | Ranunculaceae |
Ingredient ID: NPC251735
Formula: C37H40N2O6
Common Name | n.a. |
IUPAC Name | n.a. |
Canonical SMILES | COc1cc2CCN([C@@H]3c2cc1Oc1c2c(CCN([C@H]2Cc2ccc(Oc4cc(C3)ccc4O)cc2)C)cc(c1OC)OC)C |
Standard InCHI | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29-/m0/s1 |
Standard InCHIKey | HGNHIFJNOKGSKI-VMPREFPWSA-N |
Ingredient External Links |
PubChem CID: 10031631 ChEMBL ID: CHEMBL510022 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC251735] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Berberis fortunei | Berberis | Berberidaceae | |
Magnolia obovata | Magnolia | Magnoliaceae | |
Liriodendron tulipifera | Liriodendron | Magnoliaceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Xanthorhiza simplicissima | Xanthorhiza | Ranunculaceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Berberis repens | Berberis | Berberidaceae | |
Berberis amurensis | Berberis | Berberidaceae | |
Berberis thunbergii | Berberis | Berberidaceae | |
Michelia alba | Michelia | Magnoliaceae | |
Berberis integerrima | Berberis | Berberidaceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Magnolia coco | Magnolia | Magnoliaceae | |
Berberis orthobotrys | Berberis | Berberidaceae | |
Albertisia papuana | Albertisia | Menispermaceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Berberis lambertii | Berberis | Berberidaceae | |
Berberis julianae | Berberis | Berberidaceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Nelumbo nucifera | Nelumbo | Nelumbonaceae | |
Cyclea barbata | Cyclea | Menispermaceae | |
Thalictrum lucidum | Thalictrum | Ranunculaceae | |
Berberis floribunda | Berberis | Berberidaceae | |
Berberis oblonga | Berberis | Berberidaceae |
Ingredient ID: NPC200555
Formula: C20H19NO4.HI
Common Name | n.a. |
IUPAC Name | 2,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-3-ol;iodide |
Canonical SMILES | COC1=CC2=c3cc4ccc(c(c4cn3CCC2=CC1=O)OC)OC.I |
Standard InCHI | InChI=1S/C20H19NO4.HI/c1-23-18-5-4-12-8-16-14-10-19(24-2)17(22)9-13(14)6-7-21(16)11-15(12)20(18)25-3;/h4-5,8-11H,6-7H2,1-3H3;1H |
Standard InCHIKey | OZWLOJDPSVFYPW-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 5459338 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC200555] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Stephania tetrandra | Stephania | Menispermaceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Coptis japonica | Coptis | Ranunculaceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Berberis amurensis | Berberis | Berberidaceae | |
Magnolia biondii | Magnolia | Magnoliaceae | |
Berberis thunbergii | Berberis | Berberidaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Coptis omeiensis | Coptis | Ranunculaceae | |
Coptis deltoidea | Coptis | Ranunculaceae | |
Fibraurea recisa | Fibraurea | Menispermaceae | |
Coptis teetoides | Coptis | Ranunculaceae | |
Phellodendron amurense | Phellodendron | Rutaceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Berberis julianae | Berberis | Berberidaceae | |
Coptis teeta | Coptis | Ranunculaceae | |
Tinospora hainanensis | Tinospora | Menispermaceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Thalictrum lucidum | Thalictrum | Ranunculaceae | |
Coptis chinensis | Coptis | Ranunculaceae |
Ingredient ID: NPC171409
Formula: C19H14NO4
Common Name | Coptisine |
IUPAC Name | n.a. |
Canonical SMILES | C1Oc2c(O1)cc1c(c2)CC[n+]2c1cc1ccc3c(c1c2)OCO3 |
Standard InCHI | InChI=1S/C19H14NO4/c1-2-16-19(24-10-21-16)14-8-20-4-3-12-6-17-18(23-9-22-17)7-13(12)15(20)5-11(1)14/h1-2,5-8H,3-4,9-10H2/q+1 |
Standard InCHIKey | XYHOBCMEDLZUMP-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 72322 ZINC ID: ZINC000001709414 ChEMBL ID: CHEMBL362071 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC171409] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Artabotrys maingayi | Artabotrys | Annonaceae | |
Euphorbia fortissima | Euphorbia | Euphorbiaceae | |
Chelidonium majus | Chelidonium | Papaveraceae | |
Theobroma speciosum | Theobroma | Malvaceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Coptis japonica | Coptis | Ranunculaceae | |
Corydalis turtschaninovii | Corydalis | Papaveraceae | |
Corydalis decumbens | Corydalis | Papaveraceae | |
Androsace septentrionalis | Androsace | Primulaceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Calocephalus knappii | Calocephalus | Asteraceae | |
Thuja plicata | Thuja | Cupressaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Lamprocapnos spectabilis | Lamprocapnos | Papaveraceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Phellodendron chinense | Phellodendron | Rutaceae | |
Senna spectabilis | Senna | Fabaceae | |
Coptis omeiensis | Coptis | Ranunculaceae | |
Coptis deltoidea | Coptis | Ranunculaceae | |
Symphytum officinale | Symphytum | Boraginaceae | |
Fibraurea recisa | Fibraurea | Menispermaceae | |
Coptis teetoides | Coptis | Ranunculaceae | |
Psacalium peltatum | Psacalium | Asteraceae | |
Phellodendron amurense | Phellodendron | Rutaceae | |
Diospyros ebenum | Diospyros | Ebenaceae | |
Angelica dahurica | Angelica | Apiaceae | |
Corydalis ophiocarpa | Corydalis | Papaveraceae | |
Corydalis ternata | Corydalis | Papaveraceae | |
Teclea sudanica | Teclea | Rutaceae | |
Mezzettia leptopoda | Mezzettia | Annonaceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Stachys plumosa | Stachys | Lamiaceae | |
Piper methysticum | Piper | Piperaceae | |
Lappula echinata | Lappula | Boraginaceae | |
Ligularia sagitta | Ligularia | Asteraceae | |
Phellodendron chinese | Phellodendron | Rutaceae | |
Cussonia racemosa | Cussonia | Araliaceae | |
Corydalis pallida | Corydalis | Papaveraceae | |
Corydalis remota | Corydalis | Papaveraceae | |
Coptis teeta | Coptis | Ranunculaceae | |
Ulex airensis | Ulex | Fabaceae | |
Dicentra spectabilis | Dicentra | Papaveraceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Chaetomorpha moniligera | Chaetomorpha | Cladophoraceae | |
Berberis japonica | Berberis | Berberidaceae | |
Coptis chinensis | Coptis | Ranunculaceae | |
Astragalus trojanus | Astragalus | Fabaceae | |
Corydalis incisa | Corydalis | Papaveraceae | |
Aloe saponaria | Aloe | Asphodelaceae | |
Corydalis yanhusuo | Corydalis | Papaveraceae | |
Zanthoxylum nitidum | Zanthoxylum | Rutaceae |
Ingredient ID: NPC121400
Formula: C20H21NO5
Common Name | n.a. |
IUPAC Name | n.a. |
Canonical SMILES | COc1cc2C(=O)Cc3ccc4c(c3CNCCc2cc1OC)OCO4 |
Standard InCHI | InChI=1S/C20H21NO5/c1-23-18-8-13-5-6-21-10-15-12(3-4-17-20(15)26-11-25-17)7-16(22)14(13)9-19(18)24-2/h3-4,8-9,21H,5-7,10-11H2,1-2H3 |
Standard InCHIKey | WIILRXFCYJMJTC-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 371229 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC121400] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Chelidonium majus | Chelidonium | Papaveraceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Lamprocapnos spectabilis | Lamprocapnos | Papaveraceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Hylomecon japonica | Hylomecon | Papaveraceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Corydalis pallida | Corydalis | Papaveraceae | |
Dicentra spectabilis | Dicentra | Papaveraceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Argemone mexicana | Argemone | Papaveraceae | |
Papaver somniferum | Papaver | Papaveraceae |
Ingredient ID: NPC10908
Formula: C38H42N2O6
Common Name | Isotetrandrine |
IUPAC Name | n.a. |
Canonical SMILES | COc1c(OC)cc2c3c1Oc1cc4c(cc1OC)CCN([C@@H]4Cc1ccc(Oc4cc(C[C@@H]3N(CC2)C)ccc4OC)cc1)C |
Standard InCHI | InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30+/m1/s1 |
Standard InCHIKey | WVTKBKWTSCPRNU-IHLOFXLRSA-N |
Ingredient External Links |
PubChem CID: 5351212 ChEMBL ID: CHEMBL504757 |
Plant-Ingredient Association Reference |
Database: NPASS [NPC10908] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Anaxagorea luzonensis | Anaxagorea | Annonaceae | |
Argyreia nervosa | Argyreia | Convolvulaceae | |
Erythrina chiriquensis | Erythrina | Fabaceae | |
Cornus officinalis | Cornus | Cornaceae | |
Stephania tetrandra | Stephania | Menispermaceae | |
Thalictrum atriplex | Thalictrum | Ranunculaceae | |
Thalictrum foliolosum | Thalictrum | Ranunculaceae | |
Bupleurum scorzonerifolium | Bupleurum | Apiaceae | |
Croton regelianus | Croton | Euphorbiaceae | |
Thalictrum glandulosissimum | Thalictrum | Ranunculaceae | |
Thalictrum petaloideum | Thalictrum | Ranunculaceae | |
Berberis thunbergii | Berberis | Berberidaceae | |
Thalictrum minus var. hypoleucum | Thalictrum | Ranunculaceae | |
Thalictrum faberi | Thalictrum | Ranunculaceae | |
Thalictrum simplex | Thalictrum | Ranunculaceae | |
Phelipanche arenaria | Phelipanche | Orobanchaceae | |
Thalictrum microgynum | Thalictrum | Ranunculaceae | |
Carapichea ipecacuanha | Carapichea | Rubiaceae | |
Lathyrus aphaca | Lathyrus | Fabaceae | |
Thalictrum thunbergii | Thalictrum | Ranunculaceae | |
Stephania cepharantha | Stephania | Menispermaceae | |
Melianthus major | Melianthus | Melianthaceae | |
Cyclea barbata | Cyclea | Menispermaceae | |
Berberis japonica | Berberis | Berberidaceae | |
Acronychia muelleri | Acronychia | Rutaceae | |
Phoradendron reichenbachianum | Phoradendron | Viscaceae | |
Elettaria cardamomum | Elettaria | Zingiberaceae |
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NPC10908 | C38H42N2O6 | Isotetrandrine | 622.3 | 0.274 | 4.76 | 6.098 | 2 | 0 | 61.86 | 10 | 6 | 46 | 1 |
NPC121400 | C20H21NO5 | 355.1419728 | -0.7769 | 3 | 1.694 | 2 | 1 | 66.02 | 4 | 4 | 26 | 0 | |
NPC171409 | C19H14NO4 | Coptisine | 320.09 | -1.7821 | 3 | 2.823 | 0 | 0 | 40.8 | 0 | 6 | 24 | 0 |
NPC200555 | C20H19NO4.HI | 337.1314081 | -0.1035 | 3.11 | 1.92 | 3 | 0 | 48 | 6 | 4 | 25 | 0 | |
NPC251735 | C37H40N2O6 | 608.29 | -0.1345 | 4.65 | 5.579 | 2 | 1 | 72.86 | 9 | 6 | 45 | 1 | |
NPC271013 | C37H40N2O6 | Homoaromoline | 608.29 | -0.1345 | 4.65 | 5.579 | 2 | 1 | 72.86 | 9 | 6 | 45 | 1 |
NPC303581 | C21H23NO5 | 369.16 | -0.241 | 3.11 | 1.933 | 2 | 0 | 57.23 | 5 | 4 | 27 | 0 | |
NPC317145 | C38H42N2O6 | 622.3 | 0.274 | 4.76 | 6.098 | 2 | 0 | 61.86 | 10 | 6 | 46 | 1 | |
NPC49075 | C37H40N2O6 | Berbamine | 608.29 | -0.1345 | 4.65 | 5.579 | 2 | 1 | 72.86 | 9 | 6 | 45 | 1 |
NPC67978 | C21H23NO5 | Allocryptopine | 369.16 | -0.241 | 3.11 | 1.933 | 2 | 0 | 57.23 | 5 | 4 | 27 | 0 |
NPC81218 | C20H23NO4.HI | 341.1627082 | -2.3181 | 3.11 | 1.008 | 0 | 1 | 61.75 | 8 | 4 | 25 | 0 | |
NPC86469 | C20H19NO5 | Protopine | 353.13 | -0.4401 | 3 | 1.86 | 2 | 0 | 57.23 | 1 | 5 | 26 | 0 |