Ingredient ID: NPC474880
Formula: C29H36N4
Common Name | Ochrolifuanine E |
IUPAC Name | (2S,3R,12bR)-3-ethyl-2-[[(1S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-1,2,3,4,6,7,7a,12,12a,12b-decahydroindolo[2,3-a]quinolizine |
Canonical SMILES | CC[C@H]1CN2CCC3C([C@H]2C[C@@H]1C[C@@H]1NCCc2c1[nH]c1c2cccc1)Nc1c3cccc1 |
Standard InCHI | InChI=1S/C29H36N4/c1-2-18-17-33-14-12-23-21-8-4-6-10-25(21)32-29(23)27(33)16-19(18)15-26-28-22(11-13-30-26)20-7-3-5-9-24(20)31-28/h3-10,18-19,23,26-27,29-32H,2,11-17H2,1H3/t18-,19-,23?,26-,27+,29?/m0/s1 |
Standard InCHIKey | WPRCHZNIQPXBQO-QTZZMGCWSA-N |
Ingredient External Links |
PubChem CID: 44559859 ChEMBL ID: CHEMBL486025 |
Plant-Ingredient Association Reference |
PMID: 12398531 Database: NPASS [NPC474880] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Strychnos potatorum | Strychnos | Loganiaceae |
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Ingredient ID: NPC34770
Formula: C14H13NO4
Common Name | Skimmianine |
IUPAC Name | 4,7,8-trimethoxyfuro[2,3-b]quinoline |
Canonical SMILES | COc1ccc2c(c1OC)nc1c(c2OC)cco1 |
Standard InCHI | InChI=1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3 |
Standard InCHIKey | SLSIBLKBHNKZTB-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 6760 ZINC ID: ZINC000000035525 ChEMBL ID: CHEMBL21396 |
Plant-Ingredient Association Reference |
Database: UNPD [] Database: NPASS [NPC34770] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Glycosmis pseudoracemosa | Glycosmis | Rutaceae |
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Platonia insignis | Platonia | Clusiaceae |
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Ficus conraui | Ficus | Moraceae |
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Matricaria suffruticosa | Matricaria | Asteraceae |
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Dictamnus dasycarpus | Dictamnus | Rutaceae |
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Corydalis persica | Corydalis | Papaveraceae | |
Salta triflora | Salta | Polygonaceae | |
Trapa japonica | Trapa | Lythraceae |
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Inula grantioides | Inula | Asteraceae |
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Vernonia chloropappa | Vernonia | Asteraceae | |
Diospyros peregrina | Diospyros | Ebenaceae |
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Diospyros elliptifolia | Diospyros | Ebenaceae | |
Juniperus horizontalis | Juniperus | Cupressaceae |
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Acronychia laurifolia | Acronychia | Rutaceae |
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Diospyros abyssinica | Diospyros | Ebenaceae |
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Cratystylis conocephala | Cratystylis | Asteraceae | |
Strychnos spinosa | Strychnos | Loganiaceae |
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Esenbeckia hartmanii | Esenbeckia | Rutaceae | |
Talipariti tiliaceum | Talipariti | Malvaceae |
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Centaurea calcitrapa | Centaurea | Asteraceae |
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Beaucarnea recurvata | Beaucarnea | Asparagaceae | |
Peperomia pellucida | Peperomia | Piperaceae |
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Amomum daniellii | Amomum | Zingiberaceae | |
Aeollanthus buchnerianus | Aeollanthus | Lamiaceae | |
Hesperocyparis goveniana var. abramsiana | Hesperocyparis | Cupressaceae | |
Plectranthus caninus | Plectranthus | Lamiaceae |
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Wedelia prostrata | Wedelia | Asteraceae | |
Erica glauca | Erica | Ericaceae | |
Lathyrus tingitanus | Lathyrus | Fabaceae |
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Echium plantagineum | Echium | Boraginaceae |
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Rauvolfia salicifolia | Rauvolfia | Apocynaceae | |
Balanophora japonica | Balanophora | Balanophoraceae |
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Aconitum volubile | Aconitum | Ranunculaceae |
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Leucas neufliseana | Leucas | Lamiaceae | |
Espeletiopsis purpurascens | Espeletiopsis | Asteraceae | |
Leptospermum recurvum | Leptospermum | Myrtaceae | |
Cota tinctoria | Cota | Asteraceae |
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Ipomoea nil | Ipomoea | Convolvulaceae |
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Pycnarrhena australiana | Pycnarrhena | Menispermaceae | |
Amomum reticulatum | Amomum | Zingiberaceae | |
Zanthoxylum planispinum | Zanthoxylum | Rutaceae |
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Zanthoxylum avicennae | Zanthoxylum | Rutaceae |
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Hernandia sonora | Hernandia | Hernandiaceae |
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Helianthus niveus | Helianthus | Asteraceae |
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Hosta sieboldiana | Hosta | Asparagaceae |
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Plectranthus hereroensis | Plectranthus | Lamiaceae | |
Udotea petiolata | Udotea | Udoteaceae | |
Oricia suaveolens | Oricia | Rutaceae | |
Melicope semecarpifolia | Melicope | Rutaceae |
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Cynoglossum viridiflorum | Cynoglossum | Boraginaceae | |
Citrus trifoliata | Citrus | Rutaceae |
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Tecoma pentaphylla | Tecoma | Bignoniaceae | |
Phellodendron chinense | Phellodendron | Rutaceae |
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Inula salsoloides | Inula | Asteraceae | |
Eutrochium purpureum | Eutrochium | Asteraceae |
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Alchornea cordifolia | Alchornea | Euphorbiaceae |
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Caralluma russeliana | Caralluma | Apocynaceae | |
Dalbergia monetaria | Dalbergia | Fabaceae |
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Zanthoxylum ailanthoides | Zanthoxylum | Rutaceae |
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Ursinia anthemoides | Ursinia | Asteraceae | |
Imperata cylindrica | Imperata | Poaceae |
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Tetradium glabrifolium | Tetradium | Rutaceae | |
Trollius macropetalus | Trollius | Ranunculaceae | |
Polypodium aureum | Polypodium | Polypodiaceae | |
Alpinia officinarum | Alpinia | Zingiberaceae |
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Casimiroa edulis | Casimiroa | Rutaceae |
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Tylophora asthmatica | Tylophora | Apocynaceae |
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Helianthus californicus | Helianthus | Asteraceae | |
Phellodendron amurense | Phellodendron | Rutaceae |
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Morinda coreia | Morinda | Rubiaceae |
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Jacobaea cannabifolia | Jacobaea | Asteraceae | |
Skimmia japonica | Skimmia | Rutaceae |
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Conium maculatum | Conium | Apiaceae |
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Aglaia pyramidata | Aglaia | Meliaceae | |
Schrebera swietenoides | Schrebera | Oleaceae |
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Senecio gilliesi | Senecio | Asteraceae | |
Derris malaccensis | Derris | Fabaceae |
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Celastrus monospermus | Celastrus | Celastraceae | |
Beta vulgaris | Beta | Chenopodiaceae |
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Solanum spirale | Solanum | Solanaceae |
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Agave deserti | Agave | Asparagaceae |
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Asclepias subulata | Asclepias | Apocynaceae |
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Strychnos potatorum | Strychnos | Loganiaceae |
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Zanthoxylum simulans | Zanthoxylum | Rutaceae |
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Phellodendron chinese | Phellodendron | Rutaceae | |
Daphne tangutica | Daphne | Thymelaeaceae | |
Jacobaea vulgaris | Jacobaea | Asteraceae | |
Sophora leachiana | Sophora | Fabaceae |
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Murraya paniculata | Murraya | Rutaceae |
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Sarcomelicope glauca | Sarcomelicope | Rutaceae | |
Vernonia lilacina | Vernonia | Asteraceae | |
Wikstroemia chamaedaphne | Wikstroemia | Thymelaeaceae |
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Vepris punctata | Vepris | Rutaceae | |
Passiflora morifolia | Passiflora | Passifloraceae |
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Orixa japonica | Orixa | Rutaceae |
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Trifolium montanum | Trifolium | Fabaceae | |
Limonium bicolor | Limonium | Plumbaginaceae | |
Ruta graveolens | Ruta | Rutaceae |
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Hortonia floribunda | Hortonia | Monimiaceae | |
Corynanthe pachyceras | Corynanthe | Rubiaceae | |
Ulmus americana | Ulmus | Ulmaceae |
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Peucedanum praeruptorum | Peucedanum | Apiaceae |
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Reaumuria hirtella | Reaumuria | Tamaricaceae | |
Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Centaurea arenaria | Centaurea | Asteraceae | |
Coleus esquirolii | Coleus | Lamiaceae | |
Scorzonera hispanica | Scorzonera | Asteraceae |
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Zanthoxylum bungeanum | Zanthoxylum | Rutaceae |
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Peucedanum oroselinum | Peucedanum | Apiaceae | |
Ageratina saltillensis | Ageratina | Asteraceae | |
Cynoglossum amabile | Cynoglossum | Boraginaceae |
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Litsea glutinosa | Litsea | Lauraceae |
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Vicia balansae | Vicia | Fabaceae | |
Echinosophora koreensis | Echinosophora | Fabaceae | |
Gutenbergia cordifolia | Gutenbergia | Asteraceae |
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Glycosmis cochinchinensis | Glycosmis | Rutaceae |
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Garcinia intermedia | Garcinia | Clusiaceae |
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Bellium bellidioides | Bellium | Asteraceae | |
Elegia deusta | Elegia | Restionaceae | |
Atalantia wightii | Atalantia | Rutaceae | |
Sida veronicaefolia | Sida | Malvaceae |
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Salvia polystachya | Salvia | Lamiaceae |
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Toddalia asiatica | Toddalia | Rutaceae |
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Spiraea prunifolia | Spiraea | Rosaceae |
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Salvia munzii | Salvia | Lamiaceae | |
Kielmeyera coriacea | Kielmeyera | Calophyllaceae |
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Solanum transcaucasicum | Solanum | Solanaceae | |
Senecio densiflorus | Senecio | Asteraceae | |
Grewia villosa | Grewia | Malvaceae |
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Consolida hohenackeri | Consolida | Ranunculaceae | |
Angelica taiwaniana | Angelica | Apiaceae |
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Lithospermum officinale | Lithospermum | Boraginaceae |
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Zanthoxylum schinifolium | Zanthoxylum | Rutaceae |
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Euonymus europaeus | Euonymus | Celastraceae |
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Persicaria tinctoria | Persicaria | Polygonaceae |
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Sarcococca vagans | Sarcococca | Buxaceae |
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Trachelospermum lucidum | Trachelospermum | Apocynaceae |
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Phyllodium pulchellum | Phyllodium | Fabaceae |
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Zanthoxylum nitidum | Zanthoxylum | Rutaceae |
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Mikania scandens | Mikania | Asteraceae |
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Cotylelobium scabriusculum | Cotylelobium | Dipterocarpaceae | |
Cynara humilis | Cynara | Asteraceae |
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Ingredient ID: NPC308812
Formula: C9H8N2O
Common Name | n.a. |
IUPAC Name | 1-methylquinazolin-4-one |
Canonical SMILES | Cn1cnc(=O)c2c1cccc2 |
Standard InCHI | InChI=1S/C9H8N2O/c1-11-6-10-9(12)7-4-2-3-5-8(7)11/h2-6H,1H3 |
Standard InCHIKey | QAXCWBIVFCEYGG-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 18992 |
Plant-Ingredient Association Reference |
Database: UNPD [UNPD170273] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Strychnos potatorum | Strychnos | Loganiaceae |
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Daphne tangutica | Daphne | Thymelaeaceae | |
Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Ingredient ID: NPC300299
Formula: C16H14N2O
Common Name | n.a. |
IUPAC Name | 2-benzyl-1-methylquinazolin-4-one |
Canonical SMILES | O=c1nc(Cc2ccccc2)n(c2c1cccc2)C |
Standard InCHI | InChI=1S/C16H14N2O/c1-18-14-10-6-5-9-13(14)16(19)17-15(18)11-12-7-3-2-4-8-12/h2-10H,11H2,1H3 |
Standard InCHIKey | XVPZRKIQCKKYNE-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 63123 |
Plant-Ingredient Association Reference |
Database: UNPD [UNPD100925] Database: NPASS [NPC300299] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Strychnos potatorum | Strychnos | Loganiaceae |
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Daphne tangutica | Daphne | Thymelaeaceae | |
Ruta graveolens | Ruta | Rutaceae |
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Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Ingredient ID: NPC269367
Formula: C12H9NO2
Common Name | Dictamnine |
IUPAC Name | 4-methoxyfuro[2,3-b]quinoline |
Canonical SMILES | COc1c2ccccc2nc2c1cco2 |
Standard InCHI | InChI=1S/C12H9NO2/c1-14-11-8-4-2-3-5-10(8)13-12-9(11)6-7-15-12/h2-7H,1H3 |
Standard InCHIKey | WIONIXOBNMDJFJ-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 68085 ZINC ID: ZINC000000265517 ChEMBL ID: CHEMBL22533 |
Plant-Ingredient Association Reference |
Database: UNPD [] Database: NPASS [NPC269367] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Glycosmis pseudoracemosa | Glycosmis | Rutaceae |
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Ficus conraui | Ficus | Moraceae |
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Dictamnus dasycarpus | Dictamnus | Rutaceae |
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Machilus odoratissima | Machilus | Lauraceae |
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Corydalis persica | Corydalis | Papaveraceae | |
Salta triflora | Salta | Polygonaceae | |
Sideritis perfoliata | Sideritis | Lamiaceae |
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Inula grantioides | Inula | Asteraceae |
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Arachniodes mutica | Arachniodes | Dryopteridaceae | |
Vernonia chloropappa | Vernonia | Asteraceae | |
Jasione montana | Jasione | Campanulaceae | |
Juniperus horizontalis | Juniperus | Cupressaceae |
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Psiadia anchusifolia | Psiadia | Asteraceae | |
Acronychia laurifolia | Acronychia | Rutaceae |
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Strychnos spinosa | Strychnos | Loganiaceae |
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Esenbeckia hartmanii | Esenbeckia | Rutaceae | |
Talipariti tiliaceum | Talipariti | Malvaceae |
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Amomum daniellii | Amomum | Zingiberaceae | |
Plectranthus caninus | Plectranthus | Lamiaceae |
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Lathyrus tingitanus | Lathyrus | Fabaceae |
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Rauvolfia salicifolia | Rauvolfia | Apocynaceae | |
Balanophora japonica | Balanophora | Balanophoraceae |
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Angelica sinensis | Angelica | Apiaceae |
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Cota tinctoria | Cota | Asteraceae |
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Pycnarrhena australiana | Pycnarrhena | Menispermaceae | |
Zanthoxylum planispinum | Zanthoxylum | Rutaceae |
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Clausena vestita | Clausena | Rutaceae | |
Zanthoxylum avicennae | Zanthoxylum | Rutaceae |
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Hosta sieboldiana | Hosta | Asparagaceae |
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Flueggea microcarpa | Flueggea | Phyllanthaceae |
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Inula salsoloides | Inula | Asteraceae | |
Millettia pachycarpa | Millettia | Fabaceae |
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Eutrochium purpureum | Eutrochium | Asteraceae |
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Alchornea cordifolia | Alchornea | Euphorbiaceae |
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Zanthoxylum ailanthoides | Zanthoxylum | Rutaceae |
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Otholobium pubescens | Otholobium | Fabaceae | |
Tetradium glabrifolium | Tetradium | Rutaceae | |
Morinda coreia | Morinda | Rubiaceae |
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Boenninghausenia albiflora | Boenninghausenia | Rutaceae |
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Iris sanguinea | Iris | Iridaceae | |
Jacobaea cannabifolia | Jacobaea | Asteraceae | |
Mycetia nutans | Mycetia | Rubiaceae |
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Conium maculatum | Conium | Apiaceae |
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Aglaia pyramidata | Aglaia | Meliaceae | |
Schrebera swietenoides | Schrebera | Oleaceae |
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Senecio gilliesi | Senecio | Asteraceae | |
Celastrus monospermus | Celastrus | Celastraceae | |
Solanum spirale | Solanum | Solanaceae |
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Agave deserti | Agave | Asparagaceae |
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Asclepias subulata | Asclepias | Apocynaceae |
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Strychnos potatorum | Strychnos | Loganiaceae |
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Zanthoxylum simulans | Zanthoxylum | Rutaceae |
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Daphne tangutica | Daphne | Thymelaeaceae | |
Sophora leachiana | Sophora | Fabaceae |
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Rhododendron edgeworthii | Rhododendron | Ericaceae | |
Populus candicans | Populus | Salicaceae | |
Gutenbergia marginata | Gutenbergia | Asteraceae | |
Griselinia scandens | Griselinia | Griseliniaceae | |
Podocalyx loranthoides | Podocalyx | Picrodendraceae | |
Vernonia lilacina | Vernonia | Asteraceae | |
Trixis grisebachii | Trixis | Asteraceae | |
Helicia erratica | Helicia | Proteaceae |
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Croton hutchinsonianus | Croton | Euphorbiaceae | |
Cicer cuneatum | Cicer | Fabaceae | |
Bulbine asphodeloides | Bulbine | Asphodelaceae |
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Ipomoea carnea | Ipomoea | Convolvulaceae |
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Yucca elata | Yucca | Asparagaceae |
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Hyptis urticoides | Hyptis | Lamiaceae | |
Monachosorum maximowiczii | Monachosorum | Dennstaedtiaceae | |
Sarcophyton infundibuliforme | Sarcophyton | Orchidaceae | |
Delphinium speciosum | Delphinium | Ranunculaceae | |
Nardia scalaris | Nardia | Solenostomataceae | |
Passiflora morifolia | Passiflora | Passifloraceae |
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Trifolium montanum | Trifolium | Fabaceae | |
Hortonia floribunda | Hortonia | Monimiaceae | |
Corynanthe pachyceras | Corynanthe | Rubiaceae | |
Machilus zuihoensis | Machilus | Lauraceae |
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Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Zanthoxylum decaryi | Zanthoxylum | Rutaceae |
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Peucedanum oroselinum | Peucedanum | Apiaceae | |
Ageratina saltillensis | Ageratina | Asteraceae | |
Cynoglossum amabile | Cynoglossum | Boraginaceae |
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Zanthoxylum chiloperone | Zanthoxylum | Rutaceae | |
Glinus oppositifolius | Glinus | Molluginaceae |
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Vicia balansae | Vicia | Fabaceae | |
Jurinea maxima | Jurinea | Asteraceae | |
Atalantia wightii | Atalantia | Rutaceae | |
Pilocarpus grandiflorus | Pilocarpus | Rutaceae | |
Salvia polystachya | Salvia | Lamiaceae |
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Toddalia asiatica | Toddalia | Rutaceae |
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Grewia villosa | Grewia | Malvaceae |
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Gentiana strictiflora | Gentiana | Gentianaceae | |
Euonymus europaeus | Euonymus | Celastraceae |
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Persicaria tinctoria | Persicaria | Polygonaceae |
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Rosa transmorrisonensis | Rosa | Rosaceae | |
Zanthoxylum nitidum | Zanthoxylum | Rutaceae |
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Ingredient ID: NPC221786
Formula: C29H36N4
Common Name | Ochrolifuanine A |
IUPAC Name | (2S,3R,12bS)-3-ethyl-2-[[(1R)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]methyl]-1,2,3,4,6,7,7a,12,12a,12b-decahydroindolo[2,3-a]quinolizine |
Canonical SMILES | CC[C@H]1CN2CCC3C([C@@H]2C[C@@H]1C[C@H]1NCCc2c1[nH]c1c2cccc1)Nc1c3cccc1 |
Standard InCHI | InChI=1S/C29H36N4/c1-2-18-17-33-14-12-23-21-8-4-6-10-25(21)32-29(23)27(33)16-19(18)15-26-28-22(11-13-30-26)20-7-3-5-9-24(20)31-28/h3-10,18-19,23,26-27,29-32H,2,11-17H2,1H3/t18-,19-,23?,26+,27-,29?/m0/s1 |
Standard InCHIKey | WPRCHZNIQPXBQO-IWOKYBKVSA-N |
Ingredient External Links |
PubChem CID: 44559929 ChEMBL ID: CHEMBL459625 |
Plant-Ingredient Association Reference |
PMID: 12398531 Database: NPASS [NPC221786] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Strychnos potatorum | Strychnos | Loganiaceae |
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Senna tora | Senna | Fabaceae |
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Ingredient ID: NPC220241
Formula: C16H15NO4
Common Name | Arborinine |
IUPAC Name | 1-hydroxy-2,3-dimethoxy-10-methylacridin-9-one |
Canonical SMILES | COc1cc2c(c(c1OC)O)c(=O)c1c(n2C)cccc1 |
Standard InCHI | InChI=1S/C16H15NO4/c1-17-10-7-5-4-6-9(10)14(18)13-11(17)8-12(20-2)16(21-3)15(13)19/h4-8,19H,1-3H3 |
Standard InCHIKey | ATBZZQPALSPNMF-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 5281832 ChEMBL ID: CHEMBL349609 |
Plant-Ingredient Association Reference |
Database: UNPD [UNPD122031] Database: NPASS [NPC220241] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Strychnos potatorum | Strychnos | Loganiaceae |
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Daphne tangutica | Daphne | Thymelaeaceae | |
Ruta graveolens | Ruta | Rutaceae |
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Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Ingredient ID: NPC217176
Formula: C14H13NO4
Common Name | Kokusaginine |
IUPAC Name | 4,6,7-trimethoxyfuro[2,3-b]quinoline |
Canonical SMILES | COc1cc2c(cc1OC)nc1c(c2OC)cco1 |
Standard InCHI | InChI=1S/C14H13NO4/c1-16-11-6-9-10(7-12(11)17-2)15-14-8(4-5-19-14)13(9)18-3/h4-7H,1-3H3 |
Standard InCHIKey | JBRXRVFXQIKPEA-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 10227 ZINC ID: ZINC000000900216 ChEMBL ID: CHEMBL278779 |
Plant-Ingredient Association Reference |
Database: UNPD [] Database: NPASS [NPC217176] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Aeollanthus buchnerianus | Aeollanthus | Lamiaceae | |
Echium plantagineum | Echium | Boraginaceae |
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Aconitum volubile | Aconitum | Ranunculaceae |
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Leptospermum recurvum | Leptospermum | Myrtaceae | |
Hernandia sonora | Hernandia | Hernandiaceae |
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Helianthus niveus | Helianthus | Asteraceae |
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Oricia suaveolens | Oricia | Rutaceae | |
Melicope semecarpifolia | Melicope | Rutaceae |
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Cynoglossum viridiflorum | Cynoglossum | Boraginaceae | |
Derris malaccensis | Derris | Fabaceae |
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Strychnos potatorum | Strychnos | Loganiaceae |
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Euphorbia hirta | Euphorbia | Euphorbiaceae |
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Daphne tangutica | Daphne | Thymelaeaceae | |
Sarcomelicope glauca | Sarcomelicope | Rutaceae | |
Vepris punctata | Vepris | Rutaceae | |
Orixa japonica | Orixa | Rutaceae |
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Limonium bicolor | Limonium | Plumbaginaceae | |
Ruta graveolens | Ruta | Rutaceae |
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Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Zanthoxylum bungeanum | Zanthoxylum | Rutaceae |
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Glycosmis cochinchinensis | Glycosmis | Rutaceae |
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Ingredient ID: NPC182853
Formula: C16H15NO5
Common Name | n.a. |
IUPAC Name | 1,5-dihydroxy-2,3-dimethoxy-10-methylacridin-9-one |
Canonical SMILES | COc1cc2c(c(c1OC)O)c(=O)c1c(n2C)c(O)ccc1 |
Standard InCHI | InChI=1S/C16H15NO5/c1-17-9-7-11(21-2)16(22-3)15(20)12(9)14(19)8-5-4-6-10(18)13(8)17/h4-7,18,20H,1-3H3 |
Standard InCHIKey | WUPPOLDDVHCHKK-UHFFFAOYSA-N |
Ingredient External Links |
PubChem CID: 14463129 |
Plant-Ingredient Association Reference |
Database: UNPD [UNPD72697] Database: NPASS [NPC182853] |
Plant Name | Plant Genus | Plant Family | Plant Usage |
---|---|---|---|
Citropsis articulata | Citropsis | Rutaceae |
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Strychnos potatorum | Strychnos | Loganiaceae |
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Daphne tangutica | Daphne | Thymelaeaceae | |
Vitellaria paradoxa | Vitellaria | Sapotaceae |
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Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NPC182853 | C16H15NO5 | 301.0950226 | -1.1725 | 2.56 | 0.732 | 2 | 2 | 79.23 | 7 | 3 | 22 | 0 | |
NPC217176 | C14H13NO4 | Kokusaginine | 259.08 | -0.3095 | 2.45 | 1.624 | 1 | 0 | 53.72 | 6 | 3 | 19 | 0 |
NPC220241 | C16H15NO4 | Arborinine | 285.1 | -0.7122 | 2.67 | 1.906 | 2 | 1 | 59 | 6 | 3 | 21 | 0 |
NPC221786 | C29H36N4 | Ochrolifuanine A | 440.29 | -2.0406 | 4.21 | 5.917 | 4 | 3 | 43.09 | 4 | 7 | 33 | 1 |
NPC269367 | C12H9NO2 | Dictamnine | 199.06 | -0.2059 | 2.45 | 2.723 | 1 | 0 | 35.26 | 2 | 3 | 15 | 0 |
NPC300299 | C16H14N2O | 250.1106131 | -1.1092 | 2.89 | 5.993 | 3 | 0 | 32.67 | 3 | 3 | 19 | 1 | |
NPC308812 | C9H8N2O | 1-methylquinazolin-4-one | 160.0636629 | -1.2129 | 2.12 | 2.597 | 3 | 0 | 32.67 | 0 | 2 | 12 | 0 |
NPC34770 | C14H13NO4 | Skimmianine | 259.08 | -0.3095 | 2.45 | 1.624 | 1 | 0 | 53.72 | 6 | 3 | 19 | 0 |
NPC474880 | C29H36N4 | Ochrolifuanine E | 440.29 | -2.0406 | 4.21 | 5.917 | 4 | 3 | 43.09 | 4 | 7 | 33 | 1 |