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.

7 Ingredients with Available Activity

Unique ingredients have activity data available.

Ingredient Structrual Cards

Ingredient ID: NPC91745
Formula: C20H16O6

Common Name	n.a.
IUPAC Name	3,4-bis(1,3-benzodioxol-5-ylmethyl)-2H-furan-5-one
Canonical SMILES	O=C1OCC(=C1Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2
Standard InCHI	InChI=1S/C20H16O6/c21-20-15(6-13-2-4-17-19(8-13)26-11-24-17)14(9-22-20)5-12-1-3-16-18(7-12)25-10-23-16/h1-4,7-8H,5-6,9-11H2
Standard InCHIKey	DQUXXEYAJDQQTP-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 11851336 ZINC ID: ZINC000013480308
Plant-Ingredient Association Reference	Database: UNPD []

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae

Ingredient ID: NPC71950
Formula: C30H48O5

Common Name	n.a.
IUPAC Name	(4aS,6aR,6aS,6bR,8aR,9S,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Canonical SMILES	OC[C@@]1(C)[C@@H](O)[C@H](O)C[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(CC1)(C)C)C(=O)O)C)C
Standard InCHI	InChI=1S/C30H48O5/c1-25(2)11-13-30(24(34)35)14-12-28(5)18(19(30)15-25)7-8-22-26(3)16-20(32)23(33)27(4,17-31)21(26)9-10-29(22,28)6/h7,19-23,31-33H,8-17H2,1-6H3,(H,34,35)/t19-,20+,21+,22+,23-,26-,27+,28+,29+,30-/m0/s1
Standard InCHIKey	RWNHLTKFBKYDOJ-WLVUEYHVSA-N
Ingredient External Links	PubChem CID: 12305222
Plant-Ingredient Association Reference	Database: UNPD [UNPD45321]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae

Ingredient ID: NPC47653
Formula: C21H36O5

Common Name	(R)-5-Ethyl-3-Hexadecanoyl-4-Methyl-5H-Furan-2-Oneo
IUPAC Name	(2R)-4-hexadecanoyl-3-hydroxy-2-(hydroxymethyl)-2H-furan-5-one
Canonical SMILES	CCCCCCCCCCCCCCCC(=O)C1=C(O)[C@H](OC1=O)CO
Standard InCHI	InChI=1S/C21H36O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(23)19-20(24)18(16-22)26-21(19)25/h18,22,24H,2-16H2,1H3/t18-/m1/s1
Standard InCHIKey	KZTSLHQKWLYYAC-GOSISDBHSA-N
Ingredient External Links	PubChem CID: 54678922 ChEMBL ID: CHEMBL426373
Plant-Ingredient Association Reference	PMID: 18053716 Database: NPASS [NPC47653]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae
Astilbe koreana	Astilbe	Saxifragaceae
Rhododendron brachycarpum	Rhododendron	Ericaceae
Erythrina abyssinica	Erythrina	Fabaceae

Ingredient ID: NPC29353
Formula: C17H14O5

Common Name	n.a.
IUPAC Name	5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
Canonical SMILES	COc1ccc(cc1)c1cc(=O)c2c(o1)cc(cc2O)OC
Standard InCHI	InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)15-9-14(19)17-13(18)7-12(21-2)8-16(17)22-15/h3-9,18H,1-2H3
Standard InCHIKey	LZERJKGWTQYMBB-UHFFFAOYSA-N
Ingredient External Links	PubChem CID: 5281601 ZINC ID: ZINC000005733551
Plant-Ingredient Association Reference	Database: UNPD [] Database: NPASS [NPC29353]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Tristania conferta	Tristania	Myrtaceae
Plectranthus myrianthus	Plectranthus	Lamiaceae
Pentaclethra macrophylla	Pentaclethra	Fabaceae
Maackia tashiroi	Maackia	Fabaceae
Veronica polita	Veronica	Plantaginaceae
Glycosmis macrophylla	Glycosmis	Rutaceae
Colchicum filifolium	Colchicum	Colchicaceae
Stephania zippeliana	Stephania	Menispermaceae
Cynoglossum macrostylum	Cynoglossum	Boraginaceae
Eucalyptus apodophylla	Eucalyptus	Myrtaceae
Hypericum polyanthemum	Hypericum	Hypericaceae
Distephanus angulifolius	Distephanus	Asteraceae
Periploca sepium	Periploca	Apocynaceae
Campylotropis hirtella	Campylotropis	Fabaceae
Metanarthecium luteoviride	Metanarthecium	Nartheciaceae
Pulsatilla chinensis	Pulsatilla	Ranunculaceae
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae
Scutellaria barbata	Scutellaria	Lamiaceae
Mucuna holtonii	Mucuna	Fabaceae
Quercus marilandica	Quercus	Fagaceae
Pandanus tectorius	Pandanus	Pandanaceae
Centaurea scoparia	Centaurea	Asteraceae
Breonia chinensis	Breonia	Rubiaceae
Turnera diffusa	Turnera	Passifloraceae
Mimosa pigra	Mimosa	Fabaceae
Cheilanthes fragrans	Cheilanthes	Pteridaceae
Fadogia agrestis	Fadogia	Rubiaceae
Ostrya carpinifolia	Ostrya	Betulaceae
Aconitum variegatum	Aconitum	Ranunculaceae
Chrysanthemum indicum	Chrysanthemum	Asteraceae
Stephania dielsiana	Stephania	Menispermaceae
Mentha cardiaca	Mentha	Lamiaceae
Alpinia oxyphylla	Alpinia	Zingiberaceae
Maclura cochinchinensis	Maclura	Moraceae
Rhodiola semenovii	Rhodiola	Crassulaceae
Lycopodium japonicum	Lycopodium	Lycopodiaceae
Agave xylonacantha	Agave	Asparagaceae
Angelica saxatilis	Angelica	Apiaceae
Campanula choziatowskyi	Campanula	Campanulaceae
Euphorbia latazi	Euphorbia	Euphorbiaceae
Rosmarinus officinalis	Salvia	Lamiaceae
Salvia patens	Salvia	Lamiaceae
Dialium excelsum	Dialium	Fabaceae
Euphorbia hylonoma	Euphorbia	Euphorbiaceae
Senecio platyphylloides	Senecio	Asteraceae
Drymaria cordata	Drymaria	Caryophyllaceae
Boesenbergia pandurata	Boesenbergia	Zingiberaceae
Helleborus macranthus	Helleborus	Ranunculaceae
Salix rosmarinifolia	Salix	Salicaceae
Heliotropium scabrum	Heliotropium	Heliotropiaceae
Podocarpus dacrydioides	Podocarpus	Podocarpaceae
Centaurea sonchifolia	Centaurea	Asteraceae
Matricaria sabulosa	Matricaria	Asteraceae
Pterocaulon serrulatum	Pterocaulon	Asteraceae
Boswellia ovalifoliolata	Boswellia	Burseraceae
Sarcococca saligna	Sarcococca	Buxaceae
Hardenbergia violacea	Hardenbergia	Fabaceae
Lonchocarpus chiricanus	Lonchocarpus	Fabaceae
Astragalus circassicus	Astragalus	Fabaceae
Calophyllum inophyllum	Calophyllum	Calophyllaceae
Erythrina hypaphorus	Erythrina	Fabaceae
Beilschmiedia madang	Beilschmiedia	Lauraceae
Salvia lavanduloides	Salvia	Lamiaceae
Rubia akane	Rubia	Rubiaceae
Aniba santalodora	Aniba	Lauraceae
Mentzelia decapetala	Mentzelia	Loasaceae
Amorphophallus konjac	Amorphophallus	Araceae
Oroxylum indicum	Oroxylum	Bignoniaceae
Afrocarpus gracilior	Afrocarpus	Podocarpaceae
Andrographis herba	Andrographis	Acanthaceae
Derris indica	Derris	Fabaceae
Anthemis cretica	Anthemis	Asteraceae
Andrographis paniculata	Andrographis	Acanthaceae
Crotalaria candicans	Crotalaria	Fabaceae
Salvia virgata	Salvia	Lamiaceae
Eria japonica	Eria	Orchidaceae
Salvia sessei	Salvia	Lamiaceae
Juniperus drupacea	Juniperus	Cupressaceae
Petunia axillaris subsp. parodii	Petunia	Solanaceae
Ceropegia dichotoma	Ceropegia	Apocynaceae
Ononis spinosa	Ononis	Fabaceae
Antiphiona pinnatisecta	Antiphiona	Asteraceae
Crinum moorei	Crinum	Amaryllidaceae
Eucalyptus globulus subsp. bicostata	Eucalyptus	Myrtaceae
Dendrobium loddigesii	Dendrobium	Orchidaceae
Gypsophila perfoliata	Gypsophila	Caryophyllaceae
Bethencourtia palmensis	Bethencourtia	Asteraceae
Pseudocyclosorus subochthodes	Pseudocyclosorus	Thelypteridaceae
Pterocaulon virgatum	Pterocaulon	Asteraceae
Lepechinia urbanii	Lepechinia	Lamiaceae
Vernonia cistifolia	Vernonia	Asteraceae
Enicosanthum cupulare	Enicosanthum	Annonaceae
Sonneratia caseolaris	Sonneratia	Lythraceae
Daphne genkwa	Daphne	Thymelaeaceae

Ingredient ID: NPC290160
Formula: C23H16O6

Common Name	Ohioensin G
IUPAC Name	n.a.
Canonical SMILES	Oc1cc(O)c2c3c1C(=O)[C@H](O)[C@H]1[C@@H]3[C@H](c3c2c(O)ccc3)Oc2c1cccc2
Standard InCHI	InChI=1S/C23H16O6/c24-11-6-3-5-10-15(11)17-12(25)8-13(26)18-19(17)20-16(21(27)22(18)28)9-4-1-2-7-14(9)29-23(10)20/h1-8,16,20-21,23-27H/t16-,20+,21-,23+/m1/s1
Standard InCHIKey	JFOHOILWNMBZGW-QSABTFIQSA-N
Ingredient External Links	PubChem CID: 25033201 ChEMBL ID: CHEMBL403411
Plant-Ingredient Association Reference	PMID: 18053716 Database: NPASS [NPC290160]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae

Ingredient ID: NPC271038
Formula: C18H22O9

Common Name	n.a.
IUPAC Name	[(2R,3S)-2-[(2S,3S)-3-[(E,3S,4S)-3,4-diacetyloxypent-1-enyl]oxiran-2-yl]-6-oxo-2,3-dihydropyran-3-yl] acetate
Canonical SMILES	CC(=O)O[C@H]([C@@H](OC(=O)C)/C=C/[C@@H]1O[C@@H]1[C@@H]1OC(=O)C=C[C@@H]1OC(=O)C)C
Standard InCHI	InChI=1S/C18H22O9/c1-9(23-10(2)19)13(24-11(3)20)5-6-15-17(26-15)18-14(25-12(4)21)7-8-16(22)27-18/h5-9,13-15,17-18H,1-4H3/b6-5+/t9-,13-,14-,15-,17-,18+/m0/s1
Standard InCHIKey	WSMOXQBLJXEQNX-MGTBIXLTSA-N
Ingredient External Links	PubChem CID: 102116886
Plant-Ingredient Association Reference	Database: UNPD [UNPD147101]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae

Ingredient ID: NPC261447
Formula: C30H48O6

Common Name	n.a.
IUPAC Name	(1R,2R,4aS,6aR,6aS,6bR,8aR,9S,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Canonical SMILES	OC[C@@]1(C)[C@@H](O)[C@H](O)C[C@]2([C@H]1CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2[C@](C)(O)[C@@H](CC1)C)C(=O)O)C)C
Standard InCHI	InChI=1S/C30H48O6/c1-17-9-12-30(24(34)35)14-13-27(4)18(22(30)29(17,6)36)7-8-21-25(2)15-19(32)23(33)26(3,16-31)20(25)10-11-28(21,27)5/h7,17,19-23,31-33,36H,8-16H2,1-6H3,(H,34,35)/t17-,19-,20-,21-,22-,23+,25+,26-,27-,28-,29-,30+/m1/s1
Standard InCHIKey	YCOKATFNRPZIIU-SRTWMZKRSA-N
Ingredient External Links	PubChem CID: 14055737
Plant-Ingredient Association Reference	Database: UNPD [UNPD16518]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae
Bowdichia virgilioides	Bowdichia	Fabaceae
Ephedra equisetina	Ephedra	Ephedraceae
Morus alba	Morus	Moraceae

Ingredient ID: NPC184326
Formula: C23H16O5

Common Name	Ohioensin A
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)[C@@H]1Oc3ccccc3[C@@H]3[C@H]1c1c2c(O)cc(c1C(=O)C3)O
Standard InCHI	InChI=1S/C23H16O5/c24-10-5-6-12-14(7-10)23-20-13(11-3-1-2-4-18(11)28-23)8-15(25)21-17(27)9-16(26)19(12)22(20)21/h1-7,9,13,20,23-24,26-27H,8H2/t13-,20+,23+/m1/s1
Standard InCHIKey	DBGJQYIYUBGFLT-GQIHDASDSA-N
Ingredient External Links	PubChem CID: 442531 ZINC ID: ZINC000004098448 ChEMBL ID: CHEMBL403093
Plant-Ingredient Association Reference	PMID: 18053716 Database: NPASS [NPC184326]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae
Gynochthodes officinalis	Gynochthodes	Rubiaceae
Morinda officinalis	Morinda	Rubiaceae

Ingredient ID: NPC18380
Formula: C24H18O5

Common Name	Ohioensin C
IUPAC Name	n.a.
Canonical SMILES	COc1cc(O)c2c3c1c1c(O)cccc1[C@H]1[C@H]3[C@H](CC2=O)c2c(O1)cccc2
Standard InCHI	InChI=1S/C24H18O5/c1-28-18-10-16(27)21-15(26)9-13-11-5-2-3-8-17(11)29-24-12-6-4-7-14(25)19(12)22(18)23(21)20(13)24/h2-8,10,13,20,24-25,27H,9H2,1H3/t13-,20+,24+/m1/s1
Standard InCHIKey	ZVFNSNHXUYAPTP-VVTWNTARSA-N
Ingredient External Links	PubChem CID: 11740841 ChEMBL ID: CHEMBL465069
Plant-Ingredient Association Reference	PMID: 18053716 Database: NPASS [NPC18380]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae

Ingredient ID: NPC181465
Formula: C27H30O15

Common Name	Nicotifloroside
IUPAC Name	5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
Canonical SMILES	Oc1ccc(cc1)c1oc2cc(O)cc(c2c(=O)c1O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O)O
Standard InCHI	InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1
Standard InCHIKey	RTATXGUCZHCSNG-QHWHWDPRSA-N
Ingredient External Links	PubChem CID: 5318767 ZINC ID: ZINC000004349478 ChEMBL ID: CHEMBL498879
Plant-Ingredient Association Reference	Database: UNPD [] Database: NPASS [NPC181465]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Nerium oleander	Nerium	Apocynaceae
Glycosmis pseudoracemosa	Glycosmis	Rutaceae
Tropaeolum majus	Tropaeolum	Tropaeolaceae
Aristolochia maxima	Aristolochia	Aristolochiaceae
Triclisia subcordata	Triclisia	Menispermaceae
Centaurea solstitialis	Centaurea	Asteraceae
Asteriscus aquaticus	Asteriscus	Asteraceae
Syncarpia hillii	Syncarpia	Myrtaceae
Xanthorrhoea resinosa	Xanthorrhoea	Asphodelaceae
Cinnamomum subavenium	Cinnamomum	Lauraceae
Aspilia parvifolia	Aspilia	Asteraceae
Ocimum pilosum	Ocimum	Lamiaceae
Haemanthus toxicarius	Haemanthus	Amaryllidaceae
Corydalis persica	Corydalis	Papaveraceae
Pseudowintera colorata	Pseudowintera	Winteraceae
Inula grantioides	Inula	Asteraceae
Chelidonium majus	Chelidonium	Papaveraceae
Phebalium dentatum	Phebalium	Rutaceae
Betula mandshurica	Betula	Betulaceae
Ecballium elaterium	Ecballium	Cucurbitaceae
Capparis ovata	Capparis	Capparaceae
Croton montevidensis	Croton	Euphorbiaceae
Achillea collina	Achillea	Asteraceae
Lemaireocereus griseus	Lemaireocereus	Cactaceae
Rhododendron ungerni	Rhododendron	Ericaceae
Datisca glomerata	Datisca	Datiscaceae
Lagochilus leiacanthus	Lagochilus	Lamiaceae
Quercus imbricaria	Quercus	Fagaceae
Juniperus horizontalis	Juniperus	Cupressaceae
Dioscorea olfersiana	Dioscorea	Dioscoreaceae
Strychnos tricalysioides	Strychnos	Loganiaceae
Mikania obtusata	Mikania	Asteraceae
Corydalis densiflora	Corydalis	Papaveraceae
Cassine papillosa	Cassine	Celastraceae
Diospyros eriantha	Diospyros	Ebenaceae
Piptostigma fugax	Piptostigma	Annonaceae
Schleichera trijuga	Schleichera	Sapindaceae
Alkanna cappadocica	Alkanna	Boraginaceae
Thymus quinquecostatus	Thymus	Lamiaceae
Onobrychis cyri	Onobrychis	Fabaceae
Artemisia dentata	Artemisia	Asteraceae
Veronica pectinata	Veronica	Plantaginaceae
Jasminum officinale	Jasminum	Oleaceae
Chara ceratophylla	Chara	Characeae
Strychnos spinosa	Strychnos	Loganiaceae
Salvia hispanica	Salvia	Lamiaceae
Plantago lanceolata	Plantago	Plantaginaceae
Scorzonera pseudodivaricata	Scorzonera	Asteraceae
Craibiodendron yunnanense	Craibiodendron	Ericaceae
Rapanea lancifolia	Rapanea	Primulaceae
Napoleonaea vogelii	Napoleonaea	Lecythidaceae
Ononis vaginalis	Ononis	Fabaceae
Cosmos diversifolius	Cosmos	Asteraceae
Amomum daniellii	Amomum	Zingiberaceae
Bergenia purpurascens	Bergenia	Saxifragaceae
Humulus lupulus	Humulus	Cannabaceae
Trichodesma incanum	Trichodesma	Boraginaceae
Kandelia candel	Kandelia	Rhizophoraceae
Acnistus breviflorus	Acnistus	Solanaceae
Rhododendron mucronatum	Rhododendron	Ericaceae
Onobrychis viciifolia	Onobrychis	Fabaceae
Oxalis purpurea	Oxalis	Oxalidaceae
Plectranthus caninus	Plectranthus	Lamiaceae
Vitex negundo	Vitex	Lamiaceae
Lathyrus tingitanus	Lathyrus	Fabaceae
Polygala myrtifolia	Polygala	Polygalaceae
Hippeastrum papilio	Hippeastrum	Amaryllidaceae
Rauvolfia salicifolia	Rauvolfia	Apocynaceae
Lonicera japonica	Lonicera	Caprifoliaceae
Mabea fistulifera	Mabea	Euphorbiaceae
Balanophora japonica	Balanophora	Balanophoraceae
Rosa rugosa	Rosa	Rosaceae
Senna sophera	Senna	Fabaceae
Barringtonia acutangula	Barringtonia	Lecythidaceae
Tripodanthus acutifolius	Tripodanthus	Loranthaceae
Ligularia platyglossa	Ligularia	Asteraceae
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae
Embelia ribes	Embelia	Primulaceae
Rhodiola krylovii	Rhodiola	Crassulaceae
Glycyrrhiza	Glycyrrhiza	Fabaceae
Inga velutina	Inga	Fabaceae
Croton rhamnifolius	Croton	Euphorbiaceae
Astragalus adsurgens	Astragalus	Fabaceae
Cuscuta chinensis	Cuscuta	Convolvulaceae
Desmodium canadense	Desmodium	Fabaceae
Rhodiola rosea	Rhodiola	Crassulaceae
Rapanea myricoides	Rapanea	Primulaceae
Curcuma caesia	Curcuma	Zingiberaceae
Crataegus sinaica	Crataegus	Rosaceae
Malus asiatica	Malus	Rosaceae
Peucedanum japonicum	Peucedanum	Apiaceae
Baccharis solieri	Baccharis	Asteraceae
Glinus lotoides	Glinus	Molluginaceae
Cota tinctoria	Cota	Asteraceae
Glycyrrhiza inflata	Glycyrrhiza	Fabaceae
Artemisia vachanica	Artemisia	Asteraceae
Lasiocephalus ovatus	Lasiocephalus	Asteraceae
Albizia inundata	Albizia	Fabaceae
Montrouziera sphaeroidea	Montrouziera	Clusiaceae
Cotoneaster orbicularis	Cotoneaster	Rosaceae
Bischofia trifoliata	Bischofia	Phyllanthaceae
Pimpinella saxifraga	Pimpinella	Apiaceae
Caragana tibetica	Caragana	Fabaceae
Macrotyloma axillare	Macrotyloma	Fabaceae
Trigonostemon reidioides	Trigonostemon	Euphorbiaceae
Lycium chinense	Lycium	Solanaceae
Tipuana tipu	Tipuana	Fabaceae
Euphorbia ferganensis	Euphorbia	Euphorbiaceae
Arachniodes dimorphophylla	Arachniodes	Dryopteridaceae
Berberis repens	Berberis	Berberidaceae
Oreosolen wattii	Oreosolen	Scrophulariaceae
Rosa chinensis	Rosa	Rosaceae
Dalbergia sissoo	Dalbergia	Fabaceae
Carthamus tinctorius	Carthamus	Asteraceae
Atalantia racemosa	Atalantia	Rutaceae
Calophyllum thwaitesii	Calophyllum	Calophyllaceae
Discaria crenata	Discaria	Rhamnaceae
Rubus coreanus	Rubus	Rosaceae
Senecio polyodon	Senecio	Asteraceae
Thymus vulgaris	Thymus	Lamiaceae
Echinocystis lobata	Echinocystis	Cucurbitaceae
Scutellaria seleriana	Scutellaria	Lamiaceae
Phyllanthus oligospermus	Phyllanthus	Phyllanthaceae
Cathormion altissimum	Cathormion	Fabaceae
Astragalus complanatus	Astragalus	Fabaceae
Urochloa decumbens	Urochloa	Poaceae
Sophora japonica	Sophora	Fabaceae
Felicia amelloides	Felicia	Asteraceae
Arnica viscosa	Arnica	Asteraceae
Manihot esculenta	Manihot	Euphorbiaceae
Berberis crataegina	Berberis	Berberidaceae
Buddleja cordata	Buddleja	Scrophulariaceae
Paramignya griffithii	Paramignya	Rutaceae
Pteris inaequalis	Pteris	Pteridaceae
Morinda morindoides	Morinda	Rubiaceae
Tropaeolum speciosum	Tropaeolum	Tropaeolaceae
Calceolaria thyrsiflora	Calceolaria	Calceolariaceae
Crataegus pontica	Crataegus	Rosaceae
Helenium quadridentatum	Helenium	Asteraceae
Athanasia dregeana	Athanasia	Asteraceae
Acacia cambagei	Acacia	Fabaceae
Aster alpinus	Aster	Asteraceae
Sedum litoreum	Sedum	Crassulaceae
Alchornea cordifolia	Alchornea	Euphorbiaceae
Cytisus scoparius	Cytisus	Fabaceae
Lycium barbarum	Lycium	Solanaceae
Aconitum brevicalcaratum	Aconitum	Ranunculaceae
Aster koraiensis	Aster	Asteraceae
Tetradium glabrifolium	Tetradium	Rutaceae
Phlomoides medicinalis	Phlomoides	Lamiaceae
Millettia erythrocalyx	Millettia	Fabaceae
Juniperus rigida var. conferta	Juniperus	Cupressaceae
Erythrophleum couminga	Erythrophleum	Fabaceae
Crinum kirkii	Crinum	Amaryllidaceae
Hoffmannia strigillosa	Hoffmannia	Rubiaceae
Solanum bahamense	Solanum	Solanaceae
Diphasiastrum thyoides	Diphasiastrum	Lycopodiaceae
Solanum andigena	Solanum	Solanaceae
Isodon japonicus	Isodon	Lamiaceae
Ginkgo biloba	Ginkgo	Ginkgoaceae
Rubus chingii	Rubus	Rosaceae
Tinospora smilacina	Tinospora	Menispermaceae
Wyethia mollis	Wyethia	Asteraceae
Terminalia chebula	Terminalia	Combretaceae
Sarcomelicope argyrophylla	Sarcomelicope	Rutaceae
Hypericum triquetrifolium	Hypericum	Hypericaceae
Melaleuca decora	Melaleuca	Myrtaceae
Morus alba	Morus	Moraceae
Foeniculum vulgare	Foeniculum	Apiaceae
Isodon rubescens	Isodon	Lamiaceae
Coptis trifolia subsp. groenlandica	Coptis	Ranunculaceae
Khaya grandifoliola	Khaya	Meliaceae
Glycyrrhiza glabra	Glycyrrhiza	Fabaceae
Bupleurum chinense	Bupleurum	Apiaceae
Urena lobata	Urena	Malvaceae
Erythrina pallida	Erythrina	Fabaceae
Ammodendron conollyi	Ammodendron	Fabaceae
microtea debilis	Microtea	Microteaceae
sarracenia purpurea	Sarracenia	Sarraceniaceae
Alstonia undulifolia	Alstonia	Apocynaceae
Teucrium asiaticum	Teucrium	Lamiaceae
Nelumbo nucifera	Nelumbo	Nelumbonaceae
Cirsium dipsacolepis	Cirsium	Asteraceae
Mesembryanthemum anatomicum	Mesembryanthemum	Aizoaceae
Scrophularia koelzii	Scrophularia	Scrophulariaceae
Euphorbia myrsinites	Euphorbia	Euphorbiaceae
Malva sylvestris	Malva	Malvaceae
Corynanthe pachyceras	Corynanthe	Rubiaceae
Vicia amurensis	Vicia	Fabaceae
Erigeron breviscapus	Erigeron	Asteraceae
Betula platyphylla	Betula	Betulaceae
Viguiera annua	Viguiera	Asteraceae
Morinda citrifolia	Morinda	Rubiaceae
Polygonum flaccidum	Polygonum	Polygonaceae
Kopsia profunda	Kopsia	Apocynaceae
Garrya elliptica	Garrya	Garryaceae
Hubertia tomentosa	Hubertia	Asteraceae
Millettia ferruginea	Millettia	Fabaceae
Nassauvia cumingii	Nassauvia	Asteraceae
Eucalyptus australiana	Eucalyptus	Myrtaceae
Ligustrum obtusifolium	Ligustrum	Oleaceae
Peucedanum oroselinum	Peucedanum	Apiaceae
Dalbergia congestiflora	Dalbergia	Fabaceae
Cynoglossum amabile	Cynoglossum	Boraginaceae
Acorus gramineus	Acorus	Acoraceae
Euphorbia humifusa	Euphorbia	Euphorbiaceae
Helichrysum auriceps	Helichrysum	Asteraceae
Thermopsis dolichocarpa	Thermopsis	Fabaceae
Crambe tatarica	Crambe	Brassicaceae
Eria subsessilis	Eria	Orchidaceae
Ziziphus jujuba	Ziziphus	Rhamnaceae
Limnocharis flava	Limnocharis	Alismataceae
Amaranthus hypochondriacus	Amaranthus	Amaranthaceae
Conyza filaginoides	Conyza	Asteraceae
Cocculus diversifolius	Cocculus	Menispermaceae
Zanthoxylum fraxineum	Zanthoxylum	Rutaceae
Myrica multiflora	Myrica	Myricaceae
Marrubium velutinum	Marrubium	Lamiaceae
Trifolium apertum	Trifolium	Fabaceae
Atalantia wightii	Atalantia	Rutaceae
Vatica diospyroides	Vatica	Dipterocarpaceae
Solanum racemigerum	Solanum	Solanaceae
Teucrium pestalozzae	Teucrium	Lamiaceae
Glycyrrhiza uralensis	Glycyrrhiza	Fabaceae
Helicteres angustifolia	Helicteres	Malvaceae
Geranium wilfordii maxim	Geranium	Geraniaceae
Phelline lucida	Phelline	Phellinaceae
Fagus fusca	Fagus	Fagaceae
Spiracantha cornifolia	Spiracantha	Asteraceae
Lactuca serriola	Lactuca	Asteraceae
Senecio viscosus	Senecio	Asteraceae
Schultesia guianensis	Schultesia	Gentianaceae
Tylophora tanakae	Tylophora	Apocynaceae
Artocarpus altilis	Artocarpus	Moraceae
Podocarpus montanus	Podocarpus	Podocarpaceae
Camellia sinensis	Camellia	Theaceae
Croton laccifer	Croton	Euphorbiaceae
Picrorhiza kurrooa	Picrorhiza	Plantaginaceae
Knightia deplanchei	Knightia	Proteaceae
Myristica cagayanensis	Myristica	Myristicaceae
Pithecellobium clypearia	Pithecellobium	Fabaceae
Schisandra arisanensis	Schisandra	Schisandraceae
Acorus tatarinowii	Acorus	Acoraceae
Cryptocarya oblata	Cryptocarya	Lauraceae
Ptilidium ciliare	Ptilidium	Ptilidiaceae
Pteris semipinnata	Pteris	Pteridaceae
Fritillaria ningguoensis	Fritillaria	Liliaceae
Solenopsis punctaticeps	Solenopsis	Campanulaceae
Annona rensoniana	Annona	Annonaceae
Crocus sativus	Crocus	Iridaceae
Charpentiera obovata	Charpentiera	Amaranthaceae
Gardenia jasminoides	Gardenia	Rubiaceae
Lotus ucrainicus	Lotus	Fabaceae

Ingredient ID: NPC18074
Formula: C18H16O8

Common Name	(-)-Rosmarinic Acid
IUPAC Name	(2S)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid
Canonical SMILES	O=C(O[C@H](C(=O)O)Cc1ccc(c(c1)O)O)/C=C/c1ccc(c(c1)O)O
Standard InCHI	InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m0/s1
Standard InCHIKey	DOUMFZQKYFQNTF-GIZXNFQBSA-N
Ingredient External Links	PubChem CID: 639655 ZINC ID: ZINC000000901160 ChEMBL ID: CHEMBL3098862
Plant-Ingredient Association Reference	Database: UNPD [] Database: NPASS [NPC18074]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family
Clusia torresii	Clusia	Clusiaceae
Stauntonia obovatifoliola	Stauntonia	Lardizabalaceae
Glechoma longituba	Glechoma	Lamiaceae
Rauvolfia tetraphylla	Rauvolfia	Apocynaceae
Artemisia apiacea	Artemisia	Asteraceae
Artemisia hanseniana	Artemisia	Asteraceae
Ferula assa-foetida	Ferula	Apiaceae
Centella asiatica	Centella	Apiaceae
Asplenium nidus	Asplenium	Aspleniaceae
Tulipa sylvestris	Tulipa	Liliaceae
Kopsia grandifolia	Kopsia	Apocynaceae
Ledebouria socialis	Ledebouria	Hyacinthaceae
Daphne feddei	Daphne	Thymelaeaceae
Lycopus europaeus	Lycopus	Lamiaceae
Cneorum pulverulentum	Cneorum	Rutaceae
Delphinium cyphoplectrum	Delphinium	Ranunculaceae
Dipterocarpus dyeri	Dipterocarpus	Dipterocarpaceae
Thymus quinquecostatus	Thymus	Lamiaceae
Ipomoea cairica	Ipomoea	Convolvulaceae
Ceanothus velutinus	Ceanothus	Rhamnaceae
Mentha canadensis	Mentha	Lamiaceae
Garcinia scortechinii	Garcinia	Clusiaceae
Apollonias barbujana	Apollonias	Lauraceae
Cirsium helenioides	Cirsium	Asteraceae
Chlorophytum borivilianum	Chlorophytum	Asparagaceae
Salvia palaestina	Salvia	Lamiaceae
Stevia salicifolia	Stevia	Asteraceae
Orthosiphon aristatus	Orthosiphon	Lamiaceae
Handroanthus guayacan	Handroanthus	Bignoniaceae
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae
Pterocaulon rugosum	Pterocaulon	Asteraceae
Ulmus laciniata	Ulmus	Ulmaceae
Diospyros verrucosa	Diospyros	Ebenaceae
Isodon lophanthoides	Isodon	Lamiaceae
Physalis angulata	Physalis	Solanaceae
Prunella vulgaris	Prunella	Lamiaceae
Fragaria vesca	Fragaria	Rosaceae
Empetrum nigrum	Empetrum	Ericaceae
Salvia prionitis	Salvia	Lamiaceae
Thymus vulgaris	Thymus	Lamiaceae
Jateorhiza palmata	Jateorhiza	Menispermaceae
Ephedra lomatolepis	Ephedra	Ephedraceae
Arnebia guttata	Arnebia	Boraginaceae
Athanasia crithmifolia	Athanasia	Asteraceae
Lasianthus fordii	Lasianthus	Rubiaceae
Picradeniopsis oppositifolia	Picradeniopsis	Asteraceae
Angelica keiskei	Angelica	Apiaceae
Rhododendron dauricum	Rhododendron	Ericaceae
Tetraria capillaris	Tetraria	Cyperaceae
Maytenus guianensis	Maytenus	Celastraceae
Saussurea triangulata	Saussurea	Asteraceae
Phleum africanum	Phleum	Poaceae
Lindera umbellata	Lindera	Lauraceae
Lycopus lucidus	Lycopus	Lamiaceae
Stephania succifera	Stephania	Menispermaceae
Clausena indica	Clausena	Rutaceae
Notholaena dealbata	Notholaena	Pteridaceae
Gentiana olivieri	Gentiana	Gentianaceae
Vernonia serratuloides	Vernonia	Asteraceae
Perovskia abrotanoides	Salvia	Lamiaceae
Ardisia macrocarpa	Ardisia	Primulaceae
Chlorophytum malayense	Chlorophytum	Asparagaceae
Gnetum cleistostachyum	Gnetum	Gnetaceae
Pinus thunbergii	Pinus	Pinaceae
Teucrium alyssifolium	Teucrium	Lamiaceae
Orthosiphon stamineus	Orthosiphon	Lamiaceae
Senecio grandiflorus	Senecio	Asteraceae
Zephyranthes carinata	Zephyranthes	Amaryllidaceae
Angelica ursina	Angelica	Apiaceae
Pinus halepensis	Pinus	Pinaceae
Satureja montana	Satureja	Lamiaceae
Mentha arvensis	Mentha	Lamiaceae
Solanum aculeatissimum	Solanum	Solanaceae
Artemisia siversiana	Artemisia	Asteraceae
Uvaria klaineana	Uvaria	Annonaceae
Viburnum sieboldi	Viburnum	Adoxaceae
Celmisia petriei	Celmisia	Asteraceae
Smilax china	Smilax	Smilacaceae
Amentotaxus yunnanensis	Amentotaxus	Taxaceae
Tetraneuris acaulis	Tetraneuris	Asteraceae
Vicia sativa	Vicia	Fabaceae
Salvia przewalskii	Salvia	Lamiaceae
Glechoma grandis	Glechoma	Lamiaceae
Euphorbia retusa	Euphorbia	Euphorbiaceae
Isodon serra	Isodon	Lamiaceae
Agastache rugosa	Agastache	Lamiaceae
Artemisia annua	Artemisia	Asteraceae
Vatica cinerea	Vatica	Dipterocarpaceae
Camptothecium lutescens	Camptothecium	Brachytheciaceae
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
Rubia akane	Rubia	Rubiaceae
Stephania sutchuenensis	Stephania	Menispermaceae
Unonopsis glaucopetala	Unonopsis	Annonaceae
Dioscorea communis	Dioscorea	Dioscoreaceae
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
Isodon rubescens	Isodon	Lamiaceae
Bystropogon origanifolius	Bystropogon	Lamiaceae
Primula veris	Primula	Primulaceae
Sarcandra glabra	Sarcandra	Chloranthaceae
Pulsatilla koreana	Pulsatilla	Ranunculaceae
Aconitum leucostomum	Aconitum	Ranunculaceae
Euonymus maackii	Euonymus	Celastraceae
Aquilegia ecalcarata	Aquilegia	Ranunculaceae
Erigeron breviscapus	Erigeron	Asteraceae
Deguelia hatschbachii	Deguelia	Fabaceae
Fritillaria thunbergii	Fritillaria	Liliaceae
Persea mexicana	Persea	Lauraceae
Plectranthus sylvestris	Plectranthus	Lamiaceae
Bryum weigelii	Bryum	Bryaceae
Populus tremula	Populus	Salicaceae
Salvia miltiorrhiza	Salvia	Lamiaceae
Walsura chrysogyne	Walsura	Meliaceae
Morus yunnanensis	Morus	Moraceae
Astragalus inopinatus	Astragalus	Fabaceae
Jacobaea subalpina	Jacobaea	Asteraceae
Gardenia tubifera	Gardenia	Rubiaceae
Smilax glabra	Smilax	Smilacaceae
Nicotiana gossei	Nicotiana	Solanaceae
Panax innovans	Panax	Araliaceae
Blumea mollis	Blumea	Asteraceae
Oryza sativa	Oryza	Poaceae
Perilla frutescens	Perilla	Lamiaceae
Senecio integerrimus	Senecio	Asteraceae
Plantago cornuti	Plantago	Plantaginaceae

Ingredient ID: NPC137232
Formula: C23H16O6

Common Name	Ohioensin F
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)[C@@H]1Oc3ccccc3[C@@]3([C@H]1c1c2c(O)cc(c1C(=O)C3)O)O
Standard InCHI	InChI=1S/C23H16O6/c24-10-5-6-11-12(7-10)22-21-20-18(11)14(25)8-15(26)19(20)16(27)9-23(21,28)13-3-1-2-4-17(13)29-22/h1-8,21-22,24-26,28H,9H2/t21-,22-,23-/m0/s1
Standard InCHIKey	CJDAIJHZTKDLTJ-VABKMULXSA-N
Ingredient External Links	PubChem CID: 25033124 ChEMBL ID: CHEMBL403094
Plant-Ingredient Association Reference	PMID: 18053716 Database: NPASS [NPC137232]

Distribution of the ingredient across plants

Plant Name	Plant Genus	Plant Family	Plant Usage
Polytrichastrum alpinum	Polytrichastrum	Polytrichaceae

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
NPC137232	C23H16O6	Ohioensin F	388.09	-2.5939	3.33	1.584	2	4	107.22	4	6	29	0
NPC18074	C18H16O8	(-)-Rosmarinic Acid	360.08	-1.9057	2.56	2.083	4	5	144.52	12	2	26	0
NPC181465	C27H30O15	Nicotifloroside	594.16	-5.6787	2.78	-0.654	11	9	245.29	16	5	42	2
NPC18380	C24H18O5	Ohioensin C	386.12	-1.4745	3.55	3.013	1	2	75.99	4	6	29	0
NPC184326	C23H16O5	Ohioensin A	372.1	-1.883	3.44	2.494	1	3	86.99	3	6	28	0
NPC261447	C30H48O6	(1R,2R,4aS,6aR,6aS,6bR,8aR,9S,10R,11R,12aR,14bS)-1,10,11-trihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid	504.3450893	-0.2687	4.1	5.263	6	5	118.22	2	5	36	1
NPC271038	C18H22O9		382.1263823	0.089	2.45	1.444	9	0	117.73	10	2	27	0
NPC290160	C23H16O6	Ohioensin G	388.09	-2.5352	3.33	2.159	2	4	107.22	4	6	29	0
NPC29353	C17H14O5		298.0841235	-1.0675	2.78	2.605	1	1	64.99	6	3	22	0
NPC47653	C21H36O5	(R)-5-Ethyl-3-Hexadecanoyl-4-Methyl-5H-Furan-2-Oneo	368.26	-4.8028	3.22	7.591	5	2	83.83	19	1	26	2
NPC71950	C30H48O5		488.3501746	0.8164	4.21	7.537	5	4	97.99	2	5	35	1
NPC91745	C20H16O6		352.0946882	0.3041	3	2.628	6	0	63.22	4	5	26	0

Download Data

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