CMAUP Plant Ingredients

12 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.

5 Ingredients with Available Activity

Unique ingredients have activity data available.

Ingredient Structrual Cards

Ingredient ID: NPC5903
Formula: C18H18O5

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	COc1ccc2c(c1)O[C@@H]([C@@H]1[C@H]2Oc2c1ccc(c2)OC)OC
Standard InCHI	InChI=1S/C18H18O5/c1-19-10-4-6-12-14(8-10)22-17-13-7-5-11(20-2)9-15(13)23-18(21-3)16(12)17/h4-9,16-18H,1-3H3/t16-,17-,18-/m0/s1
Standard InCHIKey	KGZXHPWOBPVKDK-BZSNNMDCSA-N
Ingredient External Links
Plant-Ingredient Association Reference	Database: UNPD [UNPD98874]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Ingredient ID: NPC55832
Formula: C25H26O6

Common Name	Angustone A
IUPAC Name	3-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-6-(3-methylbut-2-enyl)chromen-4-one
Canonical SMILES	CC(=CCc1c(O)ccc(c1O)c1coc2c(c1=O)c(O)c(c(c2)O)CC=C(C)C)C
Standard InCHI	InChI=1S/C25H26O6/c1-13(2)5-7-16-19(26)10-9-15(23(16)28)18-12-31-21-11-20(27)17(8-6-14(3)4)24(29)22(21)25(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3
Standard InCHIKey	KKFAKKIIFUFASS-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 15664151 ChEMBL ID: CHEMBL3808919
Plant-Ingredient Association Reference	Database: UNPD [UNPD20185] Database: NPASS [NPC55832]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Polygonum salicifolium	Polygonum	Polygonaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae

Ingredient ID: NPC42716
Formula: C16H12O5

Common Name	Maackiain
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)OC[C@@H]1[C@H]2Oc2c1cc1c(c2)OCO1
Standard InCHI	InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2/t11-,16-/m0/s1
Standard InCHIKey	HUKSJTUUSUGIDC-ZBEGNZNMSA-N
Ingredient External Links	PubChem CID: 91510 ZINC ID: ZINC000000899884 ChEMBL ID: CHEMBL334918
Plant-Ingredient Association Reference	Database: UNPD [] Database: NPASS [NPC42716]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Abies pinsapo var. marocana	Abies	Pinaceae
Ipomoea muricata	Ipomoea	Convolvulaceae
Erysimum leptophyllum	Erysimum	Brassicaceae
Chondrodendron tomentosum	Chondrodendron	Menispermaceae
Haplophyllum obtusifolium	Haplophyllum	Rutaceae
Syzygium polycephaloides	Syzygium	Myrtaceae
Euphrasia genargentea	Euphrasia	Orobanchaceae
Xanthorhiza simplicissima	Xanthorhiza	Ranunculaceae
Glycyrrhiza	Glycyrrhiza	Fabaceae
Piper regnellii	Piper	Piperaceae
Gymnocalycium schickendantzii	Gymnocalycium	Cactaceae
Onopordum acanthium	Onopordum	Asteraceae
Pancratium sickenbergeri	Pancratium	Amaryllidaceae
Centaurea maculosa	Centaurea	Asteraceae
Ephedra sinica	Ephedra	Ephedraceae
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
Erythrina melanacantha	Erythrina	Fabaceae
Monsonia senegalensis	Monsonia	Geraniaceae
Clerodendrum bungei	Clerodendrum	Lamiaceae
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
Polygonum salicifolium	Polygonum	Polygonaceae
Sophora tomentosa	Sophora	Fabaceae
Vernonia fagifolia	Vernonia	Asteraceae
Cordia leucocephala	Cordia	Cordiaceae
Calicotome villosa	Calicotome	Fabaceae
Diplopterygium glaucum	Diplopterygium	Gleicheniaceae
Erycibe expansa	Erycibe	Convolvulaceae
Buxus natalensis	Buxus	Buxaceae
Maytenus chuchuhuasha	Maytenus	Celastraceae
Oxytropis falcata	Oxytropis	Fabaceae
Lycoris radiata	Lycoris	Amaryllidaceae
Helichrysum tenuifolium	Helichrysum	Asteraceae
Angelica acutiloba	Angelica	Apiaceae
Solanum lanceolatum	Solanum	Solanaceae
Morella rubra	Morella	Myricaceae
Bryonia alba	Bryonia	Cucurbitaceae
Viburnum erubescens	Viburnum	Adoxaceae
Remirea maritima	Remirea	Cyperaceae
Arnica mollis	Arnica	Asteraceae
Croton gratissimus	Croton	Euphorbiaceae
Wikstroemia viridiflora	Wikstroemia	Thymelaeaceae
Brassica carinata	Brassica	Brassicaceae
Ranunculus asiaticus	Ranunculus	Ranunculaceae
Eurycoma harmandiana	Eurycoma	Simaroubaceae
Eucalyptus resinifera	Eucalyptus	Myrtaceae
Sophora tonkinensis	Sophora	Fabaceae
Sinapis alba	Sinapis	Brassicaceae
Carpha glomerata	Carpha	Cyperaceae
Picrasma quassioides	Picrasma	Simaroubaceae
Cyanostegia angustifolia	Cyanostegia	Lamiaceae
Orthosiphon spicatus	Orthosiphon	Lamiaceae
Lysimachia fordiana	Lysimachia	Primulaceae
Ampelocera edentula	Ampelocera	Ulmaceae
Ixeris debilis	Ixeris	Asteraceae
Abies excelsa	Abies	Pinaceae

Ingredient ID: NPC300798
Formula: C17H14O5

Common Name	Pterocarpin
IUPAC Name	n.a.
Canonical SMILES	COc1ccc2c(c1)OC[C@@H]1[C@H]2Oc2c1cc1c(c2)OCO1
Standard InCHI	InChI=1S/C17H14O5/c1-18-9-2-3-10-13(4-9)19-7-12-11-5-15-16(21-8-20-15)6-14(11)22-17(10)12/h2-6,12,17H,7-8H2,1H3/t12-,17-/m0/s1
Standard InCHIKey	YLZYAUCOYZKLMA-SJCJKPOMSA-N
Ingredient External Links	PubChem CID: 1715306 ZINC ID: ZINC000002048856 ChEMBL ID: CHEMBL242128
Plant-Ingredient Association Reference	Database: UNPD [] Database: NPASS [NPC300798]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Ipomoea muricata	Ipomoea	Convolvulaceae
Pterocarpus santalinus	Pterocarpus	Fabaceae
Erysimum leptophyllum	Erysimum	Brassicaceae
Chondrodendron tomentosum	Chondrodendron	Menispermaceae
Haplophyllum obtusifolium	Haplophyllum	Rutaceae
Syzygium polycephaloides	Syzygium	Myrtaceae
Piper regnellii	Piper	Piperaceae
Gymnocalycium schickendantzii	Gymnocalycium	Cactaceae
Onopordum acanthium	Onopordum	Asteraceae
Pancratium sickenbergeri	Pancratium	Amaryllidaceae
Centaurea maculosa	Centaurea	Asteraceae
Ephedra sinica	Ephedra	Ephedraceae
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
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
Polygonum salicifolium	Polygonum	Polygonaceae
Vernonia fagifolia	Vernonia	Asteraceae
Cordia leucocephala	Cordia	Cordiaceae
Calicotome villosa	Calicotome	Fabaceae
Abrus pulchellus	Abrus	Fabaceae
Erycibe expansa	Erycibe	Convolvulaceae
Helichrysum tenuifolium	Helichrysum	Asteraceae
Morella rubra	Morella	Myricaceae
Pterocarpus indicus	Pterocarpus	Fabaceae
Sophora tonkinensis	Sophora	Fabaceae

Ingredient ID: NPC269760
Formula: C30H36O5

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	CC(=CCc1cc(cc(c1O)CC=C(C)C)[C@@H]1CC(=O)c2c(O1)c(CC=C(C)C)c(cc2O)O)C
Standard InCHI	InChI=1S/C30H36O5/c1-17(2)7-10-20-13-22(14-21(29(20)34)11-8-18(3)4)27-16-26(33)28-25(32)15-24(31)23(30(28)35-27)12-9-19(5)6/h7-9,13-15,27,31-32,34H,10-12,16H2,1-6H3/t27-/m0/s1
Standard InCHIKey	ABQFAJSGVWQVGF-MHZLTWQESA-N
Ingredient External Links	ZINC ID: ZINC000014821552
Plant-Ingredient Association Reference	Database: UNPD []

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Ingredient ID: NPC236766
Formula: C30H36O4

Common Name	Sophoranone
IUPAC Name	(2S)-7-hydroxy-2-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
Canonical SMILES	CC(=CCc1cc(cc(c1O)CC=C(C)C)[C@@H]1CC(=O)c2c(O1)c(CC=C(C)C)c(cc2)O)C
Standard InCHI	InChI=1S/C30H36O4/c1-18(2)7-10-21-15-23(16-22(29(21)33)11-8-19(3)4)28-17-27(32)25-13-14-26(31)24(30(25)34-28)12-9-20(5)6/h7-9,13-16,28,31,33H,10-12,17H2,1-6H3/t28-/m0/s1
Standard InCHIKey	IORSRBKNYXPSDO-NDEPHWFRSA-N
Ingredient External Links	PubChem CID: 441767 ZINC ID: ZINC000004097753 ChEMBL ID: CHEMBL3314594
Plant-Ingredient Association Reference	Database: UNPD [] Database: NPASS [NPC236766]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae
Sophora tonkinensis	Sophora	Fabaceae

Ingredient ID: NPC235260
Formula: C21H18O13

Common Name	Quercetin Glucuronide
IUPAC Name	(2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Canonical SMILES	Oc1cc(O)c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H](C(=O)O)[C@H]([C@@H]([C@H]1O)O)O)c1ccc(c(c1)O)O
Standard InCHI	InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1
Standard InCHIKey	DUBCCGAQYVUYEU-ZUGPOPFOSA-N
Ingredient External Links	PubChem CID: 5274585 ChEMBL ID: CHEMBL520546
Plant-Ingredient Association Reference	PMID: 10479312 Database: NPASS [NPC235260]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Echium pininana	Echium	Boraginaceae
Vernonia steetziana	Vernonia	Asteraceae
Ipomoea digitata	Ipomoea	Convolvulaceae
Arctium lappa	Arctium	Asteraceae
Rubus glaucus	Rubus	Rosaceae
Annona cornifolia	Annona	Annonaceae
Allium rosenorum	Allium	Amaryllidaceae
Centella asiatica	Centella	Apiaceae
Polygonum cuspidatum	Polygonum	Polygonaceae
Chelidonium majus	Chelidonium	Papaveraceae
Salvia syriaca	Salvia	Lamiaceae
Solanum laxum	Solanum	Solanaceae
Cneorum pulverulentum	Cneorum	Rutaceae
Cornus officinalis	Cornus	Cornaceae
Eucalyptus melliodora	Eucalyptus	Myrtaceae
Rhodomyrtus tomentosa	Rhodomyrtus	Myrtaceae
Scutellaria amoena	Scutellaria	Lamiaceae
Goniothalamus malayanus	Goniothalamus	Annonaceae
Pastinaca sativa	Pastinaca	Apiaceae
Hypericum hirsutum	Hypericum	Hypericaceae
Lysimachia mauritiana	Lysimachia	Primulaceae
Swertia franchetiana	Swertia	Gentianaceae
Helipterum roseum	Helipterum	Asteraceae
Hedysarum connatum	Hedysarum	Fabaceae
Zanthoxylum tetraspermum	Zanthoxylum	Rutaceae
Artemisia assoana	Artemisia	Asteraceae
Dumortiera hirsuta	Dumortiera	Dumortieraceae
Apocynum venetum	Apocynum	Apocynaceae
Lepisorus ussuriensis	Lepisorus	Polypodiaceae
Alstonia spathulata	Alstonia	Apocynaceae
Diospyros verrucosa	Diospyros	Ebenaceae
Phoebe pittieri	Phoebe	Lauraceae
Hypericum laricifolium	Hypericum	Hypericaceae
Cichorium glandulosum	Cichorium	Asteraceae
Vitis vinifera	Vitis	Vitaceae
Adiantum lunulatum	Adiantum	Pteridaceae
Ipomopsis polycladon	Ipomopsis	Polemoniaceae
Peltostigma guatemalense	Peltostigma	Rutaceae
Acacia adunca	Acacia	Fabaceae
Viguiera incana	Viguiera	Asteraceae
Astragalus sempervirens	Astragalus	Fabaceae
Marrubium anisodon	Marrubium	Lamiaceae
Wikstroemia retusa	Wikstroemia	Thymelaeaceae
Naucleopsis ternstroemiiflora	Naucleopsis	Moraceae
Solanum torvum	Solanum	Solanaceae
Tamarix aphylla	Tamarix	Tamaricaceae
Palicourea alpina	Palicourea	Rubiaceae
Lupinus formosus	Lupinus	Fabaceae
Wunderlichia mirabilis	Wunderlichia	Asteraceae
Posoqueria latifolia	Posoqueria	Rubiaceae
Dicliptera riparia	Dicliptera	Acanthaceae
Oxandra xylopioides	Oxandra	Annonaceae
Eucalyptus staigeriana	Eucalyptus	Myrtaceae
Athanasia crithmifolia	Athanasia	Asteraceae
Ilex kaushue	Ilex	Aquifoliaceae
Hylocereus ocamponis	Hylocereus	Cactaceae
Dalbergia frutescens	Dalbergia	Fabaceae
Colchicum macedonicum	Colchicum	Colchicaceae
Euphorbia caducifolia	Euphorbia	Euphorbiaceae
Boronia muelleri	Boronia	Rutaceae
Atractylodes macrocephala	Atractylodes	Asteraceae
Coprosma acerosa	Coprosma	Rubiaceae
Astilbe koreana	Astilbe	Saxifragaceae
Scrophularia smithii	Scrophularia	Scrophulariaceae
Artemisia dracunculus	Artemisia	Asteraceae
Rubus adenotrichos	Rubus	Rosaceae
Anethum graveolens	Anethum	Apiaceae
Hypericum papuanum	Hypericum	Hypericaceae
Scilla dracomontana	Scilla	Hyacinthaceae
Zilla spinosa	Zilla	Brassicaceae
Commiphora abyssinica	Commiphora	Burseraceae
Kaunia arbuscularis	Kaunia	Asteraceae
Peperomia proctorii	Peperomia	Piperaceae
Miliusa sinensis	Miliusa	Annonaceae
Trifolium pratense	Trifolium	Fabaceae
Perovskia abrotanoides	Salvia	Lamiaceae
Sambucus ebulus	Sambucus	Adoxaceae
Angelica pubescens	Angelica	Apiaceae
Inula thapsoides	Inula	Asteraceae
Tylophora flava	Tylophora	Apocynaceae
Limeum pterocarpum	Limeum	Limeaceae
Trifolium alexandrium	Trifolium	Fabaceae
Coptis deltoidea	Coptis	Ranunculaceae
Polygonum salicifolium	Polygonum	Polygonaceae
Cassia carnaval	Cassia	Fabaceae
Salix sieboldiana	Salix	Salicaceae
Mitrephora diversifolia	Mitrephora	Annonaceae
Xanthosoma violaceum	Xanthosoma	Araceae
Dillenia papuana	Dillenia	Dilleniaceae
Sesamum indicum	Sesamum	Pedaliaceae
Rumex maritimus	Rumex	Polygonaceae
Tetraneuris acaulis	Tetraneuris	Asteraceae
Persicaria orientalis	Persicaria	Polygonaceae
Dryopteris sacrosancta	Dryopteris	Dryopteridaceae
Eleusine indica	Eleusine	Poaceae
Chaenomeles sinensis	Chaenomeles	Rosaceae
Lemna trisulca	Lemna	Araceae
Rubus koehneanus	Rubus	Rosaceae
Caesalpinia pulcherrima	Caesalpinia	Fabaceae
Heimia salicifolia	Heimia	Lythraceae
Microlepia speluncae	Microlepia	Dennstaedtiaceae
Narcissus asturiensis	Narcissus	Amaryllidaceae
Astragalus interpositus	Astragalus	Fabaceae
Cardamine pinnata	Cardamine	Brassicaceae
Codonocarpus australis	Codonocarpus	Gyrostemonaceae
Schizonepeta multifida	Schizonepeta	Lamiaceae
Swertia japonica	Swertia	Gentianaceae
Quercus serrata	Quercus	Fagaceae
Crateva nurvala	Crateva	Capparaceae
Polygala amara	Polygala	Polygalaceae
Stephania sutchuenensis	Stephania	Menispermaceae
Unonopsis glaucopetala	Unonopsis	Annonaceae
Rubus rosa	Rubus	Rosaceae
Foeniculum vulgare	Foeniculum	Apiaceae
Pleogyne cunninghamii	Pleogyne	Menispermaceae
Pyrola decorata	Pyrola	Ericaceae
Pleogyne cunninghami	Pleogyne	Menispermaceae
Euonymus nanoides	Euonymus	Celastraceae
Cerbera dilatata	Cerbera	Apocynaceae
Achillea clypeolata	Achillea	Asteraceae
Bridelia ferruginea	Bridelia	Phyllanthaceae
Berberis julianae	Berberis	Berberidaceae
Zieria smithii	Zieria	Rutaceae
Bystropogon origanifolius	Bystropogon	Lamiaceae
Thamnosma rhodesica	Thamnosma	Rutaceae
Bidens sulphureus	Bidens	Asteraceae
Scutellaria orientalis	Scutellaria	Lamiaceae
Papaver hybridum	Papaver	Papaveraceae
Tanacetum argenteum	Tanacetum	Asteraceae
Sarcandra glabra	Sarcandra	Chloranthaceae
Cranfillia vulcanica	Cranfillia	Blechnaceae
Ophiopogon chekiangensis	Ophiopogon	Asparagaceae
Fallopia multiflora	Fallopia	Polygonaceae
Polygonum aviculare	Polygonum	Polygonaceae
dracocephalum ruyschiana	Dracocephalum	Lamiaceae
Nelumbo nucifera	Nelumbo	Nelumbonaceae
Calostephane divaricata	Calostephane	Asteraceae
Erigeron breviscapus	Erigeron	Asteraceae
Tripteris vaillantii	Tripteris	Asteraceae
Hypericum perforatum	Hypericum	Hypericaceae
Isatis tinctoria	Isatis	Brassicaceae
Tanacetum santolinoides	Tanacetum	Asteraceae
Persicaria thunbergii	Persicaria	Polygonaceae
Phaseolus vulgaris	Phaseolus	Fabaceae
Vaccinium oxycoccos	Vaccinium	Ericaceae
Jacobaea subalpina	Jacobaea	Asteraceae
Persicaria perfoliata	Persicaria	Polygonaceae
Salvia xalapensis	Salvia	Lamiaceae
Caragana aurantiaca	Caragana	Fabaceae
Premna odorata	Premna	Lamiaceae
Elettaria cardamomum	Elettaria	Zingiberaceae
Cotyledon secunda	Cotyledon	Crassulaceae
Ficus elastica	Ficus	Moraceae
Panopsis rubescens	Panopsis	Proteaceae
Haloxylon persicum	Haloxylon	Chenopodiaceae
Persicaria tinctoria	Persicaria	Polygonaceae
Rauvolfia vomitoria	Rauvolfia	Apocynaceae
Gnetum latifolium	Gnetum	Gnetaceae
Cichorium intybus	Cichorium	Asteraceae

Ingredient ID: NPC171396
Formula: C30H36O5

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	CC(=CCc1cc(cc(c1O)CC=C(C)C)[C@H]1Oc2c(C(=O)[C@@H]1O)ccc(c2CC=C(C)C)O)C
Standard InCHI	InChI=1S/C30H36O5/c1-17(2)7-10-20-15-22(16-21(26(20)32)11-8-18(3)4)29-28(34)27(33)24-13-14-25(31)23(30(24)35-29)12-9-19(5)6/h7-9,13-16,28-29,31-32,34H,10-12H2,1-6H3/t28-,29+/m0/s1
Standard InCHIKey	IDEMLXLPHDUUPG-URLMMPGGSA-N
Ingredient External Links
Plant-Ingredient Association Reference	Database: UNPD [UNPD75824]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Ingredient ID: NPC161375
Formula: C18H16O6

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	COc1ccc2c(c1)O[C@H]([C@@H]1[C@H]2Oc2c1cc1c(c2)OCO1)OC
Standard InCHI	InChI=1S/C18H16O6/c1-19-9-3-4-10-12(5-9)24-18(20-2)16-11-6-14-15(22-8-21-14)7-13(11)23-17(10)16/h3-7,16-18H,8H2,1-2H3/t16-,17-,18+/m0/s1
Standard InCHIKey	DBTYNEYODANUIL-OKZBNKHCSA-N
Ingredient External Links	PubChem CID: 24175352
Plant-Ingredient Association Reference	Database: UNPD [UNPD37470]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Ingredient ID: NPC143121
Formula: C18H16O6

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	COc1ccc2c(c1)O[C@@H]([C@@H]1[C@H]2Oc2c1cc1c(c2)OCO1)OC
Standard InCHI	InChI=1S/C18H16O6/c1-19-9-3-4-10-12(5-9)24-18(20-2)16-11-6-14-15(22-8-21-14)7-13(11)23-17(10)16/h3-7,16-18H,8H2,1-2H3/t16-,17-,18-/m0/s1
Standard InCHIKey	DBTYNEYODANUIL-BZSNNMDCSA-N
Ingredient External Links
Plant-Ingredient Association Reference	Database: UNPD [UNPD168102]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Ingredient ID: NPC123383
Formula: C18H18O5

Common Name	n.a.
IUPAC Name	n.a.
Canonical SMILES	COc1ccc2c(c1)O[C@H]([C@H]1[C@@H]2Oc2c1ccc(c2)OC)OC
Standard InCHI	InChI=1S/C18H18O5/c1-19-10-4-6-12-14(8-10)22-17-13-7-5-11(20-2)9-15(13)23-18(21-3)16(12)17/h4-9,16-18H,1-3H3/t16-,17-,18-/m1/s1
Standard InCHIKey	KGZXHPWOBPVKDK-KZNAEPCWSA-N
Ingredient External Links
Plant-Ingredient Association Reference	Database: UNPD [UNPD59317]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Ingredient ID: NPC11795
Formula: C26H28O6

Common Name	n.a.
IUPAC Name	5,7-dihydroxy-3-[4-hydroxy-2-methoxy-3-(3-methylbut-2-enyl)phenyl]-6-(3-methylbut-2-enyl)chromen-4-one
Canonical SMILES	COc1c(CC=C(C)C)c(O)ccc1c1coc2c(c1=O)c(O)c(c(c2)O)CC=C(C)C
Standard InCHI	InChI=1S/C26H28O6/c1-14(2)6-8-17-21(28)12-22-23(24(17)29)25(30)19(13-32-22)16-10-11-20(27)18(26(16)31-5)9-7-15(3)4/h6-7,10-13,27-29H,8-9H2,1-5H3
Standard InCHIKey	QAVJDDXEMMJOSR-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 44257315
Plant-Ingredient Association Reference	Database: UNPD [UNPD178412]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polygonum salicifolium	Polygonum	Polygonaceae

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
NPC11795	C26H28O6		436.1885886	1.6554	3.66	4.008	6	3	96.22	6	3	32	0
NPC123383	C18H18O5		314.1154237	-0.6879	2.89	2.817	5	0	46.15	3	4	23	0
NPC143121	C18H16O6		328.0946882	-0.9388	2.78	2.3	6	0	55.38	2	5	24	0
NPC161375	C18H16O6		328.0946882	-0.9388	2.78	2.3	6	0	55.38	2	5	24	0
NPC171396	C30H36O5		476.2562743	3.6259	4.21	5.935	5	3	86.99	7	3	35	1
NPC235260	C21H18O13	Quercetin Glucuronide	478.07	-4.7899	2.34	-0.197	8	8	223.67	12	4	34	1
NPC236766	C30H36O4	Sophoranone	460.26	4.2781	4.32	6.27	1	2	66.76	15	3	34	1
NPC269760	C30H36O5		476.2562743	3.8178	4.21	5.307	5	3	86.99	7	3	35	1
NPC300798	C17H14O5	Pterocarpin	298.08	-1.0076	2.78	2.316	0	0	46.15	2	5	22	0
NPC42716	C16H12O5	Maackiain	284.07	-1.4161	2.67	1.797	0	1	57.15	1	5	21	0
NPC55832	C25H26O6	Angustone A	422.17	1.2469	3.55	3.489	1	4	107.22	13	3	31	0
NPC5903	C18H18O5		314.1154237	-0.6879	2.89	2.817	5	0	46.15	3	4	23	0

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