CMAUP Plant Ingredients

29 Known Ingredients in Total

Unique ingredients have been isolated from this plant.
Plant-Ingredients Associations were manually curated from publications or collected from other databases.

7 Ingredients with Available Activity

Unique ingredients have activity data available.

Ingredient Structrual Cards

Ingredient ID: NPC98304
Formula: C22H22O9

Common Name	n.a.
IUPAC Name	2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Canonical SMILES	OC[C@H]1O[C@@H](Oc2ccc3c(c2)oc(cc3=O)c2ccc(cc2)OC)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)16-9-15(24)14-7-6-13(8-17(14)30-16)29-22-21(27)20(26)19(25)18(10-23)31-22/h2-9,18-23,25-27H,10H2,1H3/t18-,19-,20+,21-,22-/m1/s1
Standard InCHIKey	GWOKWCRSUJQOMD-QMCAAQAGSA-N
Ingredient External Links	PubChem CID: 71541772
Plant-Ingredient Association Reference	Database: TCMID [7884]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Dalbergia ecastaphyllum	Dalbergia	Fabaceae
Glycyrrhiza pallidiflora	Glycyrrhiza	Fabaceae
Astragalus mongholicus	Astragalus	Fabaceae
Amorpha fruticosa	Amorpha	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Medicago sativa	Medicago	Fabaceae
Sophora flavescens	Sophora	Fabaceae
Trifolium pratense	Trifolium	Fabaceae
Glycyrrhiza kansuensis	Glycyrrhiza	Fabaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Ononis spinosa	Ononis	Fabaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae
Pueraria montana var. lobata	Pueraria	Fabaceae

Ingredient ID: NPC74729
Formula: C9H6O4

Common Name	n.a.
IUPAC Name	4,8-dihydroxychromen-2-one
Canonical SMILES	O=c1cc(O)c2c(o1)c(O)ccc2
Standard InCHI	InChI=1S/C9H6O4/c10-6-3-1-2-5-7(11)4-8(12)13-9(5)6/h1-4,10-11H
Standard InCHIKey	YBGKGTOOPNQOKH-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 54719604
Plant-Ingredient Association Reference	Database: TCMID [4644]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Daphne tangutica	Daphne	Thymelaeaceae
Daphne odora	Daphne	Thymelaeaceae
Euphorbia lathyris	Euphorbia	Euphorbiaceae
Stellera chamaejasme	Stellera	Thymelaeaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC73738
Formula: C9H6O4

Common Name	Daphnetin
IUPAC Name	7,8-dihydroxychromen-2-one
Canonical SMILES	O=c1ccc2c(o1)c(O)c(cc2)O
Standard InCHI	InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H
Standard InCHIKey	ATEFPOUAMCWAQS-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5280569 ZINC ID: ZINC000000057753 ChEMBL ID: CHEMBL244948
Plant-Ingredient Association Reference	Database: NPASS [NPC73738]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Thymus transcaucasicus	Thymus	Lamiaceae
Bruguiera cylindrica	Bruguiera	Rhizophoraceae
Marshallia graminifolia	Marshallia	Asteraceae
Plantago uniflora	Plantago	Plantaginaceae
Acer caudatifolium	Acer	Aceraceae
Kalanchoe marmorata	Kalanchoe	Crassulaceae
Coussarea paniculata	Coussarea	Rubiaceae
Daphne feddei	Daphne	Thymelaeaceae
Baccharis macraei	Baccharis	Asteraceae
Astragalus sinicus	Astragalus	Fabaceae
Nierembergia hippomanica	Nierembergia	Solanaceae
Salacia cordata	Salacia	Celastraceae
Aconitum heterophyllum	Aconitum	Ranunculaceae
Vernonia megapotamica	Vernonia	Asteraceae
Euphorbia fischeriana	Euphorbia	Euphorbiaceae
Serratula strangulata	Serratula	Asteraceae
Mikania goyazensis	Mikania	Asteraceae
Cynoglossum formosanum	Cynoglossum	Boraginaceae
Eugenia sandwicensis	Eugenia	Myrtaceae
Lindera glauca	Lindera	Lauraceae
Chrysanthemum leptophyllum	Chrysanthemum	Asteraceae
Oxytropis ochrocephala	Oxytropis	Fabaceae
Ophioglossum petiolatum	Ophioglossum	Ophioglossaceae
Solanum aculeatissimum	Solanum	Solanaceae
Hymenocallis speciosa	Hymenocallis	Amaryllidaceae
Machilus robusta	Machilus	Lauraceae
Oyedaea verbesinoides	Oyedaea	Asteraceae
Hydrocotyle leucocephala	Hydrocotyle	Araliaceae
Pyrola calliantha	Pyrola	Ericaceae
Lonchocarpus salvadorensis	Lonchocarpus	Fabaceae
Solanum berthaultii	Solanum	Solanaceae
Chaenomeles sinensis	Chaenomeles	Rosaceae
Astragalus zahlbruckneri	Astragalus	Fabaceae
Euphorbia ebracteolata	Euphorbia	Euphorbiaceae
Daphne odora	Daphne	Thymelaeaceae
Thymus magnus	Thymus	Lamiaceae
Ecbolium linneanum	Ecbolium	Acanthaceae
Euphorbia lathyris	Euphorbia	Euphorbiaceae
Jacobaea arnautorum	Jacobaea	Asteraceae
Rumohra adiantiformis	Rumohra	Dryopteridaceae
Stellera chamaejasme	Stellera	Thymelaeaceae
Ligularia pleurocaulis	Ligularia	Asteraceae
Cicer arietinum	Cicer	Fabaceae
Pseudophegopteris subaurita	Pseudophegopteris	Thelypteridaceae
Polypodiodes formosana	Polypodiodes	Polypodiaceae
Symphytum tuberosum	Symphytum	Boraginaceae

Ingredient ID: NPC39064
Formula: C16H14O4

Common Name	n.a.
IUPAC Name	(6aR,11aR)-9-methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol
Canonical SMILES	COc1ccc2c(c1)O[C@@H]1[C@H]2COc2c1ccc(c2)O
Standard InCHI	InChI=1S/C16H14O4/c1-18-10-3-5-11-13-8-19-14-6-9(17)2-4-12(14)16(13)20-15(11)7-10/h2-7,13,16-17H,8H2,1H3/t13-,16-/m0/s1
Standard InCHIKey	NSRJSISNDPOJOP-BBRMVZONSA-N
Ingredient External Links	PubChem CID: 336327 ZINC ID: ZINC000000011544
Plant-Ingredient Association Reference	Database: NPASS [NPC39064]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Mitracarpus scaber	Mitracarpus	Rubiaceae
Thalictrum flavum	Thalictrum	Ranunculaceae
Echinops transiliensis	Echinops	Asteraceae
Lantana montevidensis	Lantana	Verbenaceae
Senecio suaveolens	Senecio	Asteraceae
Olearia pimeleoides	Olearia	Asteraceae
Muscari botryoides	Muscari	Hyacinthaceae
Dasycladus vermicularis	Dasycladus	Dasycladaceae
Astragalus mongholicus	Astragalus	Fabaceae
Glycyrrhiza	Glycyrrhiza	Fabaceae
Teclea gerrardii	Teclea	Rutaceae
Avena sativa	Avena	Poaceae
Salvia castanea	Salvia	Lamiaceae
Dalbergia odorifera	Dalbergia	Fabaceae
Trifolium pratense	Trifolium	Fabaceae
Stellaria holostea	Stellaria	Caryophyllaceae
Alpinia officinarum	Alpinia	Zingiberaceae
Astragalus membranaceus	Astragalus	Fabaceae
Arachis hypogaea	Arachis	Fabaceae
Dalbergia assamica	Dalbergia	Fabaceae
Hedysarum polybotrys	Hedysarum	Fabaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae
Hedysarum theinum	Hedysarum	Fabaceae
Pueraria montana var. lobata	Pueraria	Fabaceae
Haemanthus amarylloides	Haemanthus	Amaryllidaceae

Ingredient ID: NPC329225
Formula: C15H12O4

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2)O
Standard InCHI	InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2
Standard InCHIKey	FURUXTVZLHCCNA-UHFFFAOYSA-N
Ingredient External Links
Plant-Ingredient Association Reference	Database: NPASS [NPC329225]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Dalbergia odorifera	Dalbergia	Fabaceae
Sophora flavescens	Sophora	Fabaceae
Epimedium koreanum	Epimedium	Berberidaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Robinia pseudoacacia	Robinia	Fabaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC294412
Formula: C16H12O5

Common Name	n.a.
IUPAC Name	7-hydroxy-3-(4-methoxyphenyl)-4-oxochromen-5-olate
Canonical SMILES	COc1ccc(cc1)c1coc2c(c1=O)c(O)cc(c2)[O-]
Standard InCHI	InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3/p-1
Standard InCHIKey	WUADCCWRTIWANL-UHFFFAOYSA-M
Ingredient External Links	PubChem CID: 25203224
Plant-Ingredient Association Reference	Database: TCMID [2384]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Murraya exotica	Murraya	Rutaceae
Vitex negundo	Vitex	Lamiaceae
Astragalus mongholicus	Astragalus	Fabaceae
Trifolium subterraneum	Trifolium	Fabaceae
Trifolium pratense	Trifolium	Fabaceae
Astragalus membranaceus	Astragalus	Fabaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Murraya paniculata	Murraya	Rutaceae
Fallopia multiflora	Fallopia	Polygonaceae
Myristica malabarica	Myristica	Myristicaceae
Glycine max	Glycine	Fabaceae
Cicer arietinum	Cicer	Fabaceae
Pueraria montana var. lobata	Pueraria	Fabaceae

Ingredient ID: NPC294409
Formula: C16H12O5

Common Name	Biochanin
IUPAC Name	5,7-dihydroxy-3-(4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1)c1coc2c(c1=O)c(O)cc(c2)O
Standard InCHI	InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3
Standard InCHIKey	WUADCCWRTIWANL-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5280373 ZINC ID: ZINC000018847037 ChEMBL ID: CHEMBL131921
Plant-Ingredient Association Reference	Database: NPASS [NPC294409]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Triclisia subcordata	Triclisia	Menispermaceae
Aspilia parvifolia	Aspilia	Asteraceae
Inulanthera calva	Inulanthera	Asteraceae
Erysimum leptophyllum	Erysimum	Brassicaceae
Chondrodendron tomentosum	Chondrodendron	Menispermaceae
Nicotiana raimondii	Nicotiana	Solanaceae
Murraya exotica	Murraya	Rutaceae
Haplophyllum obtusifolium	Haplophyllum	Rutaceae
Corydalis densiflora	Corydalis	Papaveraceae
Schleichera trijuga	Schleichera	Sapindaceae
Syzygium polycephaloides	Syzygium	Myrtaceae
Craibiodendron yunnanense	Craibiodendron	Ericaceae
Napoleonaea vogelii	Napoleonaea	Lecythidaceae
Persea kusanoi	Persea	Lauraceae
Dalbergia parviflora	Dalbergia	Fabaceae
Klasea sogdiana	Klasea	Asteraceae
Vitex negundo	Vitex	Lamiaceae
Mabea fistulifera	Mabea	Euphorbiaceae
Barringtonia acutangula	Barringtonia	Lecythidaceae
Astragalus mongholicus	Astragalus	Fabaceae
Embelia ribes	Embelia	Primulaceae
Scolopia chinensis	Scolopia	Salicaceae
Astragalus adsurgens	Astragalus	Fabaceae
Piper regnellii	Piper	Piperaceae
Desmodium canadense	Desmodium	Fabaceae
Citrus wilsonii	Citrus	Rutaceae
Gymnocalycium schickendantzii	Gymnocalycium	Cactaceae
Onopordum acanthium	Onopordum	Asteraceae
Pancratium sickenbergeri	Pancratium	Amaryllidaceae
Centaurea maculosa	Centaurea	Asteraceae
Ephedra sinica	Ephedra	Ephedraceae
Dalbergia sissoo	Dalbergia	Fabaceae
Plathymenia reticulata	Plathymenia	Fabaceae
Asimina parviflora	Asimina	Annonaceae
Pteridium esculentum	Pteridium	Dennstaedtiaceae
Esenbeckia leiocarpa	Esenbeckia	Rutaceae
Sophora flavescens	Sophora	Fabaceae
Hypericum styphelioides	Hypericum	Hypericaceae
Vellozia nanuzae	Vellozia	Velloziaceae
Baccharis neglecta	Baccharis	Asteraceae
Atraphaxis spinosa	Atraphaxis	Polygonaceae
Embelia schimperi	Embelia	Primulaceae
Epilobium hirsutum	Epilobium	Onagraceae
Lythrum salicaria	Lythrum	Lythraceae
Simarouba glauca	Simarouba	Simaroubaceae
Dalbergia frutescens	Dalbergia	Fabaceae
Erythrina melanacantha	Erythrina	Fabaceae
Monsonia senegalensis	Monsonia	Geraniaceae
Clerodendrum bungei	Clerodendrum	Lamiaceae
Lemaireocereus longispinus	Lemaireocereus	Cactaceae
Eria anomala	Eria	Orchidaceae
Embelia parviflora	Embelia	Primulaceae
Euphorbia nematocypha	Euphorbia	Euphorbiaceae
Abelia chinensis	Abelia	Caprifoliaceae
Diospyros assimilis	Diospyros	Ebenaceae
Faramea salicifolia	Faramea	Rubiaceae
Trifolium pratense	Trifolium	Fabaceae
Croton megistocarpus	Croton	Euphorbiaceae
Vernonia fagifolia	Vernonia	Asteraceae
Cordia leucocephala	Cordia	Cordiaceae
Astragalus membranaceus	Astragalus	Fabaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Heliotropium hirsutissimum	Heliotropium	Heliotropiaceae
Murraya paniculata	Murraya	Rutaceae
Helichrysum tenuifolium	Helichrysum	Asteraceae
Khaya grandifoliola	Khaya	Meliaceae
Fallopia multiflora	Fallopia	Polygonaceae
Cudrania tricuspidata	Maclura	Moraceae
Morella rubra	Morella	Myricaceae
Trollius europaeus	Trollius	Ranunculaceae
Geranium sibiricum	Geranium	Geraniaceae
Baphicacanthus cusia	Baphicacanthus	Acanthaceae
Lagerstroemia indica	Lagerstroemia	Lythraceae
Dalbergia congestiflora	Dalbergia	Fabaceae
Senecio isatideus	Senecio	Asteraceae
Schultesia guianensis	Schultesia	Gentianaceae
Cicer arietinum	Cicer	Fabaceae
Trigonella foenum-graecum	Trigonella	Fabaceae
Asclepias vestita	Asclepias	Apocynaceae
Pueraria montana var. lobata	Pueraria	Fabaceae
Arum maximum	Arum	Araceae

Ingredient ID: NPC291428
Formula: C16H12O4

Common Name	n.a.
IUPAC Name	7-hydroxy-3-(4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1)[13c]1coc2c([13c]1=O)ccc([13cH]2)O
Standard InCHI	InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3/i8+1,14+1,16+1
Standard InCHIKey	HKQYGTCOTHHOMP-OPOMHRLSSA-N
Ingredient External Links	PubChem CID: 10378473
Plant-Ingredient Association Reference	Database: TCMID [7882]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Dalbergia ecastaphyllum	Dalbergia	Fabaceae
Aquilaria sinensis	Aquilaria	Thymelaeaceae
Glycyrrhiza pallidiflora	Glycyrrhiza	Fabaceae
Astragalus mongholicus	Astragalus	Fabaceae
Amorpha fruticosa	Amorpha	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Andira inermis	Andira	Fabaceae
Medicago sativa	Medicago	Fabaceae
Sophora flavescens	Sophora	Fabaceae
Trifolium subterraneum	Trifolium	Fabaceae
Stemona tuberosa	Stemona	Stemonaceae
Artemisia anomala	Artemisia	Asteraceae
Trifolium pratense	Trifolium	Fabaceae
Typha latifolia	Typha	Typhaceae
Astragalus membranaceus	Astragalus	Fabaceae
Arachis hypogaea	Arachis	Fabaceae
Virola multinervia	Virola	Myristicaceae
Ginkgo biloba	Ginkgo	Ginkgoaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Flemingia philippinensis	Flemingia	Fabaceae
Ononis spinosa	Ononis	Fabaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Pterocarpus indicus	Pterocarpus	Fabaceae
Cicer arietinum	Cicer	Fabaceae
Pueraria montana var. lobata	Pueraria	Fabaceae

Ingredient ID: NPC286233
Formula: C3H4O3

Common Name	n.a.
IUPAC Name	2-oxopropanoic acid
Canonical SMILES	OC(=O)C(=O)C
Standard InCHI	InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)
Standard InCHIKey	LCTONWCANYUPML-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 1060
Plant-Ingredient Association Reference	Database: NPASS [NPC286233]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Passiflora incarnata	Passiflora	Passifloraceae
Alstonia muelleriana	Alstonia	Apocynaceae
Aloe vera	Aloe	Xanthorrhoeaceae
Dacrydium cupressinum	Dacrydium	Podocarpaceae
Torilis japonica	Torilis	Apiaceae
Trigonella grandiflora	Trigonella	Fabaceae
Nicotiana undulata	Nicotiana	Solanaceae
Artemisia cina	Artemisia	Asteraceae
Aloe ferox	Aloe	Asphodelaceae
Bupleurum scorzonerifolium	Bupleurum	Apiaceae
Cnidium monnieri	Cnidium	Apiaceae
Capsicum annuum	Capsicum	Solanaceae
Krameria parvifolia	Krameria	Krameriaceae
Aesculus turbinata	Aesculus	Hippocastanaceae
Argyreia speciosa	Argyreia	Convolvulaceae
Vernonia profuga	Vernonia	Asteraceae
Lycium chinense	Lycium	Solanaceae
Artocarpus styracifolius	Artocarpus	Moraceae
Tripolium pannonicum	Tripolium	Asteraceae
Swertia chinensis	Swertia	Gentianaceae
Forsythia giraldiana	Forsythia	Oleaceae
Dorstenia mannii	Dorstenia	Moraceae
Coreopsis nodosa	Coreopsis	Asteraceae
Uvaria calamistrata	Uvaria	Annonaceae
Haematococcus lacustris	Haematococcus	Haematococcaceae
Alnus alnobetula	Alnus	Betulaceae
Lycium barbarum	Lycium	Solanaceae
Typha latifolia	Typha	Typhaceae
Thermopsis mollis	Thermopsis	Fabaceae
Crinum latifolium	Crinum	Amaryllidaceae
Aloe spicata	Aloe	Asphodelaceae
Panax ginseng	Panax	Araliaceae
Bupleurum chinense	Bupleurum	Apiaceae
Aloe africana	Aloe	Xanthorrhoeaceae
Bupleurum falcatum	Bupleurum	Apiaceae
Alnus cordata	Alnus	Betulaceae
Melia indica	Melia	Meliaceae
Aloe deltoideodonta	Aloe	Asphodelaceae
Glycine tomentella	Glycine	Fabaceae
Bauhinia purpurea	Bauhinia	Fabaceae
Panax schinseng	Panax	Araliaceae
Citrus aurantium	Citrus	Rutaceae
Cicer arietinum	Cicer	Fabaceae
Senecio paludaffinis	Senecio	Asteraceae
Leitneria floridana	Leitneria	Simaroubaceae
Notholaena aschenborniana	Notholaena	Pteridaceae
Cnidium monieri	Cnidium	Apiaceae

Ingredient ID: NPC266597
Formula: C16H12O4

Common Name	Pratol
IUPAC Name	7-hydroxy-2-(4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2)O
Standard InCHI	InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)15-9-14(18)13-7-4-11(17)8-16(13)20-15/h2-9,17H,1H3
Standard InCHIKey	SQVXWIUVAILQRH-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5320693 ZINC ID: ZINC000005733557 ChEMBL ID: CHEMBL16751
Plant-Ingredient Association Reference	Database: NPASS [NPC266597]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Trifolium pratense	Trifolium	Fabaceae
Hedysarum polybotrys	Hedysarum	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC259767
Formula: C21H22O9

Common Name	Isoliquiritin
IUPAC Name	(E)-1-(2,4-dihydroxyphenyl)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-en-1-one
Canonical SMILES	OC[C@H]1O[C@@H](Oc2ccc(cc2)/C=C/C(=O)c2ccc(cc2O)O)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C21H22O9/c22-10-17-18(26)19(27)20(28)21(30-17)29-13-5-1-11(2-6-13)3-8-15(24)14-7-4-12(23)9-16(14)25/h1-9,17-23,25-28H,10H2/b8-3+/t17-,18-,19+,20-,21-/m1/s1
Standard InCHIKey	YNWXJFQOCHMPCK-LXGDFETPSA-N
Ingredient External Links	PubChem CID: 5318591 ZINC ID: ZINC000033832004 ChEMBL ID: CHEMBL599763
Plant-Ingredient Association Reference	Database: NPASS [NPC259767]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Mitracarpus scaber	Mitracarpus	Rubiaceae
Glycyrrhiza yunnanensis	Glycyrrhiza	Fabaceae
Onobrychis viciifolia	Onobrychis	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Glycyrrhiza aspera	Glycyrrhiza	Fabaceae
Sophora tomentosa	Sophora	Fabaceae
Glycyrrhiza kansuensis	Glycyrrhiza	Fabaceae
Sigesbeckia pubescens	Sigesbeckia	Asteraceae
Aralia subcapitata	Aralia	Araliaceae
Sigesbeckia glabrescens	Sigesbeckia	Asteraceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Robinia pseudoacacia	Robinia	Fabaceae
Portulaca oleracea	Portulaca	Portulacaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC239568
Formula: C15H16O9

Common Name	n.a.
IUPAC Name	7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
Canonical SMILES	OC[C@H]1O[C@@H](Oc2c(O)ccc3c2oc(=O)cc3)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C15H16O9/c16-5-8-10(19)11(20)12(21)15(22-8)24-14-7(17)3-1-6-2-4-9(18)23-13(6)14/h1-4,8,10-12,15-17,19-21H,5H2/t8-,10-,11+,12-,15+/m1/s1
Standard InCHIKey	MMPBHSBVPREJQC-GCJOFGIHSA-N
Ingredient External Links	PubChem CID: 5316301 ZINC ID: ZINC000031157928
Plant-Ingredient Association Reference	Database: TCMID [4645]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Marshallia graminifolia	Marshallia	Asteraceae
Acer caudatifolium	Acer	Aceraceae
Baccharis macraei	Baccharis	Asteraceae
Astragalus sinicus	Astragalus	Fabaceae
Salacia cordata	Salacia	Celastraceae
Aconitum heterophyllum	Aconitum	Ranunculaceae
Vernonia megapotamica	Vernonia	Asteraceae
Serratula strangulata	Serratula	Asteraceae
Mikania goyazensis	Mikania	Asteraceae
Cynoglossum formosanum	Cynoglossum	Boraginaceae
Eugenia sandwicensis	Eugenia	Myrtaceae
Lindera glauca	Lindera	Lauraceae
Chrysanthemum leptophyllum	Chrysanthemum	Asteraceae
Oxytropis ochrocephala	Oxytropis	Fabaceae
Daphne odora	Daphne	Thymelaeaceae
Euphorbia lathyris	Euphorbia	Euphorbiaceae
Rumohra adiantiformis	Rumohra	Dryopteridaceae
Stellera chamaejasme	Stellera	Thymelaeaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC236658
Formula: C48H78O18

Common Name	n.a.
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylate
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)[O-])O[C@H]2CC[C@]3([C@H]([C@@]2(C)CO)CC[C@@]2([C@@H]3CC=C3[C@@]2(C)CC[C@@]2([C@H]3CC(C)(C)C[C@H]2O)C)C)C)[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C48H78O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-38,40-42,49-58H,10-20H2,1-8H3,(H,59,60)/p-1/t21-,23-,24+,25+,26+,27+,28-,29-,30-,31+,32-,33-,34-,35+,36-,37+,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1
Standard InCHIKey	PTDAHAWQAGSZDD-IOVCITQVSA-M
Ingredient External Links	PubChem CID: 53477584
Plant-Ingredient Association Reference	Database: TCMID [20111]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Sophora flavescens	Sophora	Fabaceae
Lens culinaris	Lens	Fabaceae
Abrus pulchellus	Abrus	Fabaceae
Glycine max	Glycine	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC228824
Formula: C15H12O5

Common Name	n.a.
IUPAC Name	3,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Canonical SMILES	Oc1ccc(cc1)C1Oc2cc(O)ccc2C(=O)C1O
Standard InCHI	InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)15-14(19)13(18)11-6-5-10(17)7-12(11)20-15/h1-7,14-17,19H
Standard InCHIKey	VRTGGIJPIYOHGT-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 3512634
Plant-Ingredient Association Reference	Database: TCMID [8201]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Corymbia citriodora	Corymbia	Myrtaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC226690
Formula: C16H8O6

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)oc(=O)c1c2oc2c1cc1c(c2)OCO1
Standard InCHI	InChI=1S/C16H8O6/c17-7-1-2-8-10(3-7)22-16(18)14-9-4-12-13(20-6-19-12)5-11(9)21-15(8)14/h1-5,17H,6H2
Standard InCHIKey	URMVEUAWRUQHON-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5319322 ZINC ID: ZINC000002561256
Plant-Ingredient Association Reference	Database: TCMID [13629] Database: TCM_Taiwan

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Medicago sativa	Medicago	Fabaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC214299
Formula: C38H50O6

Common Name	n.a.
IUPAC Name	(1R,3E,5S,7S)-3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6,6-dimethyl-5,7-bis(3-methylbut-2-enyl)-1-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)bicyclo[3.3.1]nonane-2,4,9-trione
Canonical SMILES	CC(=CC[C@@]12C(=O)/C(=C(c3ccc(c(c3)O)O)/O)/C(=O)[C@](C1=O)(CC(C(=C)C)CC=C(C)C)C[C@@H](C2(C)C)CC=C(C)C)C
Standard InCHI	InChI=1S/C38H50O6/c1-22(2)11-13-27(25(7)8)20-37-21-28(15-12-23(3)4)36(9,10)38(35(37)44,18-17-24(5)6)34(43)31(33(37)42)32(41)26-14-16-29(39)30(40)19-26/h11-12,14,16-17,19,27-28,39-41H,7,13,15,18,20-21H2,1-6,8-10H3/b32-31+/t27?,28-,37-,38+/m0/s1
Standard InCHIKey	DTTONLKLWRTCAB-LHLSIRLOSA-N
Ingredient External Links	PubChem CID: 10031531
Plant-Ingredient Association Reference	Database: TCMID [8217]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Garcinia cambogia	Garcinia	Clusiaceae
Corymbia citriodora	Corymbia	Myrtaceae
Garcinia dulcis	Garcinia	Clusiaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC209560
Formula: C16H12O4

Common Name	Formononetin
IUPAC Name	7-hydroxy-3-(4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)O
Standard InCHI	InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3
Standard InCHIKey	HKQYGTCOTHHOMP-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5280378 ZINC ID: ZINC000018847036 ChEMBL ID: CHEMBL242341
Plant-Ingredient Association Reference	Database: NPASS [NPC209560]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Mitracarpus scaber	Mitracarpus	Rubiaceae
Abies pinsapo var. marocana	Abies	Pinaceae
Allagopappus viscosissimus	Allagopappus	Asteraceae
Erysimum leptophyllum	Erysimum	Brassicaceae
Astragalus spinosus	Astragalus	Fabaceae
Swertia decussata	Swertia	Gentianaceae
Peltogyne pubescens	Peltogyne	Fabaceae
Chondrodendron tomentosum	Chondrodendron	Menispermaceae
Thalictrum flavum	Thalictrum	Ranunculaceae
Ranunculus peltatus	Ranunculus	Ranunculaceae
Albizia julibrissin	Albizia	Fabaceae
Murraya exotica	Murraya	Rutaceae
Hydrangea serrata	Hydrangea	Hydrangeaceae
Haplophyllum obtusifolium	Haplophyllum	Rutaceae
Lunularia cruciata	Lunularia	Lunulariaceae
Onobrychis cyri	Onobrychis	Fabaceae
Echinops transiliensis	Echinops	Asteraceae
Syzygium polycephaloides	Syzygium	Myrtaceae
Euphrasia genargentea	Euphrasia	Orobanchaceae
Persea kusanoi	Persea	Lauraceae
Dalbergia parviflora	Dalbergia	Fabaceae
Acnistus breviflorus	Acnistus	Solanaceae
Oxalis purpurea	Oxalis	Oxalidaceae
Xanthorhiza simplicissima	Xanthorhiza	Ranunculaceae
Lantana montevidensis	Lantana	Verbenaceae
Senecio suaveolens	Senecio	Asteraceae
Olearia pimeleoides	Olearia	Asteraceae
Glycyrrhiza pallidiflora	Glycyrrhiza	Fabaceae
Muscari botryoides	Muscari	Hyacinthaceae
Dasycladus vermicularis	Dasycladus	Dasycladaceae
Astragalus mongholicus	Astragalus	Fabaceae
Glycyrrhiza	Glycyrrhiza	Fabaceae
Piper regnellii	Piper	Piperaceae
Teclea gerrardii	Teclea	Rutaceae
Ginkgo semen	Ginkgo	Ginkgoaceae
Avena sativa	Avena	Poaceae
Gymnocalycium schickendantzii	Gymnocalycium	Cactaceae
Salvia castanea	Salvia	Lamiaceae
Glinus lotoides	Glinus	Molluginaceae
Amorpha fruticosa	Amorpha	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Albizia inundata	Albizia	Fabaceae
Onopordum acanthium	Onopordum	Asteraceae
Sparganium stoloniferum	Sparganium	Typhaceae
Pancratium sickenbergeri	Pancratium	Amaryllidaceae
Tipuana tipu	Tipuana	Fabaceae
Centaurea maculosa	Centaurea	Asteraceae
Dalbergia odorifera	Dalbergia	Fabaceae
Ephedra sinica	Ephedra	Ephedraceae
Medicago sativa	Medicago	Fabaceae
Papaver tatricum	Papaver	Papaveraceae
Plathymenia reticulata	Plathymenia	Fabaceae
Asimina parviflora	Asimina	Annonaceae
Pteridium esculentum	Pteridium	Dennstaedtiaceae
Esenbeckia leiocarpa	Esenbeckia	Rutaceae
Sophora flavescens	Sophora	Fabaceae
Hypericum styphelioides	Hypericum	Hypericaceae
Vellozia nanuzae	Vellozia	Velloziaceae
Baccharis neglecta	Baccharis	Asteraceae
Atraphaxis spinosa	Atraphaxis	Polygonaceae
Embelia schimperi	Embelia	Primulaceae
Epilobium hirsutum	Epilobium	Onagraceae
Lythrum salicaria	Lythrum	Lythraceae
Simarouba glauca	Simarouba	Simaroubaceae
Dalbergia frutescens	Dalbergia	Fabaceae
Erythrina melanacantha	Erythrina	Fabaceae
Monsonia senegalensis	Monsonia	Geraniaceae
Clerodendrum bungei	Clerodendrum	Lamiaceae
Wisteria brachybotrys	Wisteria	Fabaceae
Lemaireocereus longispinus	Lemaireocereus	Cactaceae
Eria anomala	Eria	Orchidaceae
Embelia parviflora	Embelia	Primulaceae
Dactylorhiza viridis	Dactylorhiza	Orchidaceae
Euphorbia nematocypha	Euphorbia	Euphorbiaceae
Pterolobium hexapetalum	Pterolobium	Fabaceae
Abelia chinensis	Abelia	Caprifoliaceae
Diospyros assimilis	Diospyros	Ebenaceae
Faramea salicifolia	Faramea	Rubiaceae
Trifolium pratense	Trifolium	Fabaceae
Croton megistocarpus	Croton	Euphorbiaceae
Vernonia fagifolia	Vernonia	Asteraceae
Cordia leucocephala	Cordia	Cordiaceae
Stellaria holostea	Stellaria	Caryophyllaceae
Rosulabryum capillare	Rosulabryum	Bryaceae
Citrus rugulosa	Citrus	Rutaceae
Diplopterygium glaucum	Diplopterygium	Gleicheniaceae
Astragalus membranaceus	Astragalus	Fabaceae
Hedysarum multijugum maxim	Hedysarum	Fabaceae
Xanthium strumarium	Xanthium	Asteraceae
Aglaia australiensis	Aglaia	Meliaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Erycibe expansa	Erycibe	Convolvulaceae
Glycine soja	Glycine	Fabaceae
Macadamia ternifolia	Macadamia	Proteaceae
Maytenus chuchuhuasha	Maytenus	Celastraceae
Dorstenia dinklagei	Dorstenia	Moraceae
Croton zehntneri	Croton	Euphorbiaceae
Murraya paniculata	Murraya	Rutaceae
Oxytropis falcata	Oxytropis	Fabaceae
Helichrysum tenuifolium	Helichrysum	Asteraceae
Sapium haematospermum	Sapium	Euphorbiaceae
Angelica acutiloba	Angelica	Apiaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Fallopia multiflora	Fallopia	Polygonaceae
Pueraria lobata	Pueraria	Fabaceae
Solanum lanceolatum	Solanum	Solanaceae
Morella rubra	Morella	Myricaceae
Desmodium styracifolium	Desmodium	Fabaceae
Diplacus longiflorus	Diplacus	Phrymaceae
Bryonia alba	Bryonia	Cucurbitaceae
Achillea pseudopectinata	Achillea	Asteraceae
Viburnum erubescens	Viburnum	Adoxaceae
Dalbergia assamica	Dalbergia	Fabaceae
Geranium sibiricum	Geranium	Geraniaceae
Remirea maritima	Remirea	Cyperaceae
Baphicacanthus cusia	Baphicacanthus	Acanthaceae
Lagerstroemia indica	Lagerstroemia	Lythraceae
Syzygium nervosum	Syzygium	Myrtaceae
Arnica mollis	Arnica	Asteraceae
Lepidosperma ustulatum	Lepidosperma	Cyperaceae
Garrya elliptica	Garrya	Garryaceae
Nassauvia cumingii	Nassauvia	Asteraceae
Croton gratissimus	Croton	Euphorbiaceae
Salvia miltiorrhiza	Salvia	Lamiaceae
Wikstroemia viridiflora	Wikstroemia	Thymelaeaceae
Brassica carinata	Brassica	Brassicaceae
Dunalia solanacea	Dunalia	Solanaceae
Ononis spinosa	Ononis	Fabaceae
Hedysarum polybotrys	Hedysarum	Fabaceae
Ranunculus asiaticus	Ranunculus	Ranunculaceae
Eurycoma harmandiana	Eurycoma	Simaroubaceae
Berberis floribunda	Berberis	Berberidaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Jamesoniella colorata	Jamesoniella	Jungermanniaceae
Eucalyptus resinifera	Eucalyptus	Myrtaceae
Fumaria micrantha	Fumaria	Papaveraceae
Senecio isatideus	Senecio	Asteraceae
Sophora tonkinensis	Sophora	Fabaceae
Sinapis alba	Sinapis	Brassicaceae
Pterodon emarginatus	Pterodon	Fabaceae
Cicer arietinum	Cicer	Fabaceae
Berlinia tomentosa	Berlinia	Fabaceae
Trigonella foenum-graecum	Trigonella	Fabaceae
Carpha glomerata	Carpha	Cyperaceae
Cymodocea nodosa	Cymodocea	Cymodoceaceae
Picrorhiza kurrooa	Picrorhiza	Plantaginaceae
Hedysarum theinum	Hedysarum	Fabaceae
Bonamia spectabilis	Bonamia	Convolvulaceae
Pueraria montana var. lobata	Pueraria	Fabaceae
Cyanostegia angustifolia	Cyanostegia	Lamiaceae
Atuna racemosa	Atuna	Chrysobalanaceae
Orthosiphon spicatus	Orthosiphon	Lamiaceae
Haemanthus amarylloides	Haemanthus	Amaryllidaceae
Astragalus pycnanthus	Astragalus	Fabaceae
Pulsatilla campanella	Pulsatilla	Ranunculaceae
Lysimachia fordiana	Lysimachia	Primulaceae
Ampelocera edentula	Ampelocera	Ulmaceae
Ixeris debilis	Ixeris	Asteraceae
Abies excelsa	Abies	Pinaceae

Ingredient ID: NPC198385
Formula: C22H24O10

Common Name	n.a.
IUPAC Name	5-hydroxy-3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Canonical SMILES	OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)OCC(C3=O)c2ccc(cc2)OC)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C22H24O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,13,16,19-24,26-28H,8-9H2,1H3/t13?,16-,19-,20+,21-,22-/m1/s1
Standard InCHIKey	LDIPBJAHMYDBEB-BJPMNQBHSA-N
Ingredient External Links	PubChem CID: 5315461
Plant-Ingredient Association Reference	Database: TCMID [2386]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC194654
Formula: C16H12O6

Common Name	n.a.
IUPAC Name	7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-5-olate
Canonical SMILES	COc1ccc(cc1O)c1coc2c(c1=O)c(O)cc(c2)[O-]
Standard InCHI	InChI=1S/C16H12O6/c1-21-13-3-2-8(4-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3/p-1
Standard InCHIKey	FPIOBTBNRZPWJW-UHFFFAOYSA-M
Ingredient External Links	PubChem CID: 25201808
Plant-Ingredient Association Reference	Database: TCMID [32919]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Inula britannica	Inula	Asteraceae
Trifolium pratense	Trifolium	Fabaceae
Peucedanum praeruptorum	Peucedanum	Apiaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC194653
Formula: C16H12O6

Common Name	n.a.
IUPAC Name	5,7-dihydroxy-3-(3-hydroxy-4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1O)c1coc2c(c1=O)c(O)cc(c2)O
Standard InCHI	InChI=1S/C16H12O6/c1-21-13-3-2-8(4-11(13)18)10-7-22-14-6-9(17)5-12(19)15(14)16(10)20/h2-7,17-19H,1H3
Standard InCHIKey	FPIOBTBNRZPWJW-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5281803
Plant-Ingredient Association Reference	Database: NPASS [NPC194653]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Polyalthia barnesii	Polyalthia	Annonaceae
Striga lutea	Striga	Orobanchaceae
Crotalaria medicaginea	Crotalaria	Fabaceae
Eria alba	Eria	Orchidaceae
Sidastrum burrerense	Sidastrum	Malvaceae
Psychotria st	Psychotria	Rubiaceae
Dalbergia parviflora	Dalbergia	Fabaceae
Yucca recurvifolia	Yucca	Asparagaceae
Astragalus mongholicus	Astragalus	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Dalbergia sissoo	Dalbergia	Fabaceae
Bassia scoparia	Bassia	Chenopodiaceae
Trifolium pratense	Trifolium	Fabaceae
Cytisus scoparius	Cytisus	Fabaceae
Astragalus membranaceus	Astragalus	Fabaceae
Fritillaria stenanthera	Fritillaria	Liliaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Calocephalus citreus	Calocephalus	Asteraceae
Genista pichisermolliana	Genista	Fabaceae
Eria floribunda	Eria	Orchidaceae
Kopsia teoi	Kopsia	Apocynaceae
Rubus lambertianus	Rubus	Rosaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae
Brickellia cylindracea	Brickellia	Asteraceae
Stevia paniculata	Stevia	Asteraceae

Ingredient ID: NPC19174
Formula: C15H12O4

Common Name	Isoliquiritigenin
IUPAC Name	(E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Canonical SMILES	Oc1ccc(cc1)/C=C/C(=O)c1ccc(cc1O)O
Standard InCHI	InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3+
Standard InCHIKey	DXDRHHKMWQZJHT-FPYGCLRLSA-N
Ingredient External Links	PubChem CID: 638278 ZINC ID: ZINC000003869608 ChEMBL ID: CHEMBL129795
Plant-Ingredient Association Reference	Database: NPASS [NPC19174]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Mitracarpus scaber	Mitracarpus	Rubiaceae
Abies pinsapo var. marocana	Abies	Pinaceae
Teucrium betonicum	Teucrium	Lamiaceae
Centaurea solstitialis	Centaurea	Asteraceae
Xanthorrhoea resinosa	Xanthorrhoea	Asphodelaceae
Ocimum pilosum	Ocimum	Lamiaceae
Psorothamnus arborescens	Psorothamnus	Fabaceae
Rhododendron ungerni	Rhododendron	Ericaceae
Albizia julibrissin	Albizia	Fabaceae
Lagochilus leiacanthus	Lagochilus	Lamiaceae
Glycyrrhiza yunnanensis	Glycyrrhiza	Fabaceae
Strychnos tricalysioides	Strychnos	Loganiaceae
Piptostigma fugax	Piptostigma	Annonaceae
Chara ceratophylla	Chara	Characeae
Euphrasia genargentea	Euphrasia	Orobanchaceae
Cosmos diversifolius	Cosmos	Asteraceae
Trichodesma incanum	Trichodesma	Boraginaceae
Dalbergia parviflora	Dalbergia	Fabaceae
Rhododendron mucronatum	Rhododendron	Ericaceae
Onobrychis viciifolia	Onobrychis	Fabaceae
Xanthorhiza simplicissima	Xanthorhiza	Ranunculaceae
Astragalus mongholicus	Astragalus	Fabaceae
Glycyrrhiza	Glycyrrhiza	Fabaceae
Inga velutina	Inga	Fabaceae
Curcuma caesia	Curcuma	Zingiberaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Crinum bulbispermum	Crinum	Amaryllidaceae
Dalbergia odorifera	Dalbergia	Fabaceae
Cathormion altissimum	Cathormion	Fabaceae
Urochloa decumbens	Urochloa	Poaceae
Dactylorhiza viridis	Dactylorhiza	Orchidaceae
Pterolobium hexapetalum	Pterolobium	Fabaceae
Polygonatum cyrtonema	Polygonatum	Asparagaceae
Sophora tomentosa	Sophora	Fabaceae
Dalbergia louvelii	Dalbergia	Fabaceae
Diplopterygium glaucum	Diplopterygium	Gleicheniaceae
Platymiscium floribundum	Platymiscium	Fabaceae
Erythrophleum couminga	Erythrophleum	Fabaceae
Astragalus membranaceus	Astragalus	Fabaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Maytenus chuchuhuasha	Maytenus	Celastraceae
Anemarrhena asphodeloides	Anemarrhena	Asparagaceae
Oxytropis falcata	Oxytropis	Fabaceae
Polygonatum kingianum	Polygonatum	Asparagaceae
Angelica acutiloba	Angelica	Apiaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Erythrina pallida	Erythrina	Fabaceae
Solanum lanceolatum	Solanum	Solanaceae
Bryonia alba	Bryonia	Cucurbitaceae
Sophora mollis	Sophora	Fabaceae
Dracaena draco	Dracaena	Asparagaceae
Robinia pseudoacacia	Robinia	Fabaceae
Viburnum erubescens	Viburnum	Adoxaceae
Remirea maritima	Remirea	Cyperaceae
Arnica mollis	Arnica	Asteraceae
Dipteryx odorata	Dipteryx	Fabaceae
Eucalyptus australiana	Eucalyptus	Myrtaceae
Croton gratissimus	Croton	Euphorbiaceae
Wikstroemia viridiflora	Wikstroemia	Thymelaeaceae
Polygonatum falcatum	Polygonatum	Asparagaceae
Brassica carinata	Brassica	Brassicaceae
Turpinia arguta	Turpinia	Staphyleaceae
Hedysarum polybotrys	Hedysarum	Fabaceae
Ranunculus asiaticus	Ranunculus	Ranunculaceae
Eurycoma harmandiana	Eurycoma	Simaroubaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Eucalyptus resinifera	Eucalyptus	Myrtaceae
Allium azureum ledeb	Allium	Amaryllidaceae
Phelline lucida	Phelline	Phellinaceae
Glycine max	Glycine	Fabaceae
Lactuca serriola	Lactuca	Asteraceae
Sinapis alba	Sinapis	Brassicaceae
Cicer arietinum	Cicer	Fabaceae
Artocarpus altilis	Artocarpus	Moraceae
Carpha glomerata	Carpha	Cyperaceae
Cryptocarya oblata	Cryptocarya	Lauraceae
Cyanostegia angustifolia	Cyanostegia	Lamiaceae
Orthosiphon spicatus	Orthosiphon	Lamiaceae
Solenopsis punctaticeps	Solenopsis	Campanulaceae
Lysimachia fordiana	Lysimachia	Primulaceae
Ampelocera edentula	Ampelocera	Ulmaceae
Ixeris debilis	Ixeris	Asteraceae
Polygonatum sibiricum	Polygonatum	Asparagaceae
Abies excelsa	Abies	Pinaceae

Ingredient ID: NPC186732
Formula: C59H96O29

Common Name	n.a.
IUPAC Name	(2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,8aR,9S,10R,14bR)-9-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)C(=O)O)O[C@H]2CC[C@]3(C([C@@]2(C)CO)CC[C@@]2(C3CC=C3C2(C)CC[C@@]2(C3CC(C)(C)[C@H]([C@H]2O[C@@H]2OC[C@H]([C@@H]([C@H]2O)O[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)O)O)C)C)C)[C@@H]([C@H]([C@H]1O)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
Standard InCHI	InChI=1S/C59H96O29/c1-54(2)16-23-22-8-9-29-56(4)12-11-30(83-53-45(38(72)37(71)43(85-53)48(77)78)87-52-44(36(70)33(67)27(19-62)82-52)86-51-40(74)35(69)32(66)26(18-61)81-51)57(5,21-63)28(56)10-13-59(29,7)58(22,6)15-14-55(23,3)47(46(54)76)88-49-41(75)42(24(64)20-79-49)84-50-39(73)34(68)31(65)25(17-60)80-50/h8,23-47,49-53,60-76H,9-21H2,1-7H3,(H,77,78)/t23?,24-,25-,26-,27-,28?,29?,30+,31-,32-,33+,34+,35+,36+,37+,38+,39-,40-,41-,42+,43+,44-,45-,46+,47-,49+,50+,51+,52+,53-,55-,56+,57-,58?,59-/m1/s1
Standard InCHIKey	XFXHYKZIZSNVSQ-KGYUGUMBSA-N
Ingredient External Links	PubChem CID: 11968947
Plant-Ingredient Association Reference	Database: TCMID [20105]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Sophora flavescens	Sophora	Fabaceae
Lens culinaris	Lens	Fabaceae
Glycine max	Glycine	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC175867
Formula: C17H16O6

Common Name	n.a.
IUPAC Name	(3R)-3-(2,4-dimethoxyphenyl)-7-hydroxy-4-oxo-2,3-dihydrochromen-5-olate
Canonical SMILES	COc1ccc(c(c1)OC)[C@@H]1COc2c(C1=O)c(O)cc(c2)[O-]
Standard InCHI	InChI=1S/C17H16O6/c1-21-10-3-4-11(14(7-10)22-2)12-8-23-15-6-9(18)5-13(19)16(15)17(12)20/h3-7,12,18-19H,8H2,1-2H3/p-1/t12-/m0/s1
Standard InCHIKey	LMLDNMHDNFCNCW-LBPRGKRZSA-M
Ingredient External Links	PubChem CID: 25200813
Plant-Ingredient Association Reference	Database: TCMID [9605]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC151898
Formula: C15H12O4

Common Name	n.a.
IUPAC Name	(2R)-7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
Canonical SMILES	Oc1ccc(cc1)[C@H]1CC(=O)c2c(O1)cc(cc2)O
Standard InCHI	InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2/t14-/m1/s1
Standard InCHIKey	FURUXTVZLHCCNA-CQSZACIVSA-N
Ingredient External Links	PubChem CID: 928837
Plant-Ingredient Association Reference	Database: TCMID [12902]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Mitracarpus scaber	Mitracarpus	Rubiaceae
Glycyrrhiza	Glycyrrhiza	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Liquidambar formosana	Liquidambar	Altingiaceae
Dalbergia odorifera	Dalbergia	Fabaceae
Datura inoxia	Datura	Solanaceae
Epimedium koreanum	Epimedium	Berberidaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Robinia pseudoacacia	Robinia	Fabaceae
Scrophularia ningpoensis	Scrophularia	Scrophulariaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC149867
Formula: C25H34O6

Common Name	n.a.
IUPAC Name	[(2R,3R,3aR,7S,7aR)-7,7a-dimethyl-3-[(Z)-2-methylbut-2-enoyl]oxy-4'-methylidene-2'-oxospiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-4-yl] (Z)-2-methylbut-2-enoate
Canonical SMILES	C/C=C(C(=O)OC1CC[C@@H]([C@@]2([C@H]1[C@@H](OC(=O)/C(=CC)/C)[C@@]1(C2)C(=C)COC1=O)C)C)/C
Standard InCHI	InChI=1S/C25H34O6/c1-8-14(3)21(26)30-18-11-10-16(5)24(7)13-25(17(6)12-29-23(25)28)20(19(18)24)31-22(27)15(4)9-2/h8-9,16,18-20H,6,10-13H2,1-5,7H3/b14-8-,15-9-/t16-,18?,19+,20+,24+,25+/m0/s1
Standard InCHIKey	SRBBDMVRDLLMJD-FGWCDJEDSA-N
Ingredient External Links	PubChem CID: 5318080
Plant-Ingredient Association Reference	Database: TCMID [9606]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Petasites japonicus	Petasites	Asteraceae
Cicer arietinum	Cicer	Fabaceae

Ingredient ID: NPC115159
Formula: C15H12O4

Common Name	(Z)-1-(2,4-Dihydroxyphenyl)-3-(4-Hydroxyphenyl)Prop-2-En-1-One
IUPAC Name	(Z)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Canonical SMILES	Oc1ccc(cc1)/C=CC(=O)c1ccc(cc1O)O
Standard InCHI	InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3-
Standard InCHIKey	DXDRHHKMWQZJHT-BAQGIRSFSA-N
Ingredient External Links	PubChem CID: 6603886 ZINC ID: ZINC000003869607 ChEMBL ID: CHEMBL1395334
Plant-Ingredient Association Reference	Database: NPASS [NPC115159]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Glycyrrhiza yunnanensis	Glycyrrhiza	Fabaceae
Onobrychis viciifolia	Onobrychis	Fabaceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Sophora tomentosa	Sophora	Fabaceae
Hedysarum multijugum maxim	Hedysarum	Fabaceae
Spatholobus suberectus	Spatholobus	Fabaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Dracaena draco	Dracaena	Asparagaceae
Robinia pseudoacacia	Robinia	Fabaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Cicer arietinum	Cicer	Fabaceae

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
NPC115159	C15H12O4	(Z)-1-(2,4-Dihydroxyphenyl)-3-(4-Hydroxyphenyl)Prop-2-En-1-One	256.07	-1.2836	2.67	2.764	1	3	77.76	6	2	19	0
NPC149867	C25H34O6	[(2R,3R,3aR,7S,7aR)-7,7a-dimethyl-3-[(Z)-2-methylbut-2-enoyl]oxy-4'-methylidene-2'-oxospiro[3,3a,4,5,6,7-hexahydro-1H-indene-2,3'-oxolane]-4-yl] (Z)-2-methylbut-2-enoate	430.2355388	3.0103	3.55	4.997	6	0	78.9	6	3	31	0
NPC151898	C15H12O4	(2R)-7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	256.0735589	-1.3541	2.67	1.86	1	2	66.76	1	3	19	0
NPC175867	C17H16O6	(3R)-3-(2,4-dimethoxyphenyl)-7-hydroxy-4-oxo-2,3-dihydrochromen-5-olate	315.0868632	-1.909	2.67	0.805	1	1	88.05	3	3	23	0
NPC186732	C59H96O29	(2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,8aR,9S,10R,14bR)-9-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid	1268.603727	-7.3469	4.76	-0.612	29	18	473.51	15	10	88	3
NPC19174	C15H12O4	Isoliquiritigenin	256.07	-1.2836	2.67	2.764	1	3	77.76	6	2	19	0
NPC194653	C16H12O6		300.0633881	-2.0994	2.56	1.068	1	3	96.22	6	3	22	0
NPC194654	C16H12O6	7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-5-olate	299.0555631	-2.4332	2.56	1.068	1	2	99.05	2	3	22	0
NPC198385	C22H24O10	5-hydroxy-3-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one	448.136947	-3.2703	2.78	0.141	6	5	155.14	5	4	32	0
NPC209560	C16H12O4	Formononetin	268.07	-1.1788	2.78	2.994	1	1	55.76	4	3	20	0
NPC214299	C38H50O6	(1R,3E,5S,7S)-3-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-6,6-dimethyl-5,7-bis(3-methylbut-2-enyl)-1-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)bicyclo[3.3.1]nonane-2,4,9-trione	602.3607393	4.4704	4.98	10.069	4	3	111.9	10	3	44	1
NPC226690	C16H8O6		296.032088	-1.0082	2.56	1.954	1	1	78.13	0	5	22	0
NPC228824	C15H12O5	3,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one	272.0684735	-2.0063	2.56	1.525	2	3	86.99	1	3	20	0
NPC236658	C48H78O18	(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylate	941.5109906	-3.9685	4.76	3.675	18	10	297.81	9	8	66	2
NPC239568	C15H16O9	7-hydroxy-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one	340.0794321	-2.3975	2.12	-0.539	6	5	145.91	3	3	24	0
NPC259767	C21H22O9	Isoliquiritin	418.13	-3.0305	2.78	1.656	6	6	156.91	12	3	30	1
NPC266597	C16H12O4	Pratol	268.07	-1.0157	2.78	3.049	1	1	55.76	4	3	20	0
NPC286233	C3H4O3		88.01604399	-0.4937	1.46	-0.426	3	1	54.37	3	0	6	0
NPC291428	C16H12O4	7-hydroxy-3-(4-methoxyphenyl)chromen-4-one	268.0735589	-1.1788	2.78	2.994	1	1	55.76	2	3	20	0
NPC294409	C16H12O5	Biochanin	284.07	-1.6391	2.67	2.031	1	2	75.99	5	3	21	0
NPC294412	C16H12O5	7-hydroxy-3-(4-methoxyphenyl)-4-oxochromen-5-olate	283.0606485	-1.9729	2.67	2.031	1	1	78.82	2	3	21	0
NPC329225	C15H12O4		256.07	-1.3541	2.67	1.86	1	2	66.76	3	3	19	0
NPC39064	C16H14O4		270.0892089	-1.1652	2.78	2.314	0	1	47.92	3	4	20	0
NPC73738	C9H6O4	Daphnetin	178.03	-0.6506	2.01	0.998	1	2	66.76	2	2	13	0
NPC74729	C9H6O4	4,8-dihydroxychromen-2-one	178.0266087	-0.7534	2.01	1.118	2	2	66.76	0	2	13	0
NPC98304	C22H22O9	2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	430.1263823	-2.7626	2.89	1.941	6	4	134.91	5	4	31	0

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Data Section	Select to Download
1. General Information & structure data (InChi, InChiKey, SMILES)
2. Physico-chemical Properties