15 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.
6 Ingredients with Available Activity
Unique ingredients have activity data available.
Ingredient Structrual Cards
Ingredient ID: NPC88445
Formula: C16H14O4
Ingredient ID: NPC88445
| Common Name | Isoimperatorin |
| IUPAC Name | 4-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one |
| Canonical SMILES | CC(=CCOc1c2ccoc2cc2c1ccc(=O)o2)C |
| Standard InCHI | InChI=1S/C16H14O4/c1-10(2)5-7-19-16-11-3-4-15(17)20-14(11)9-13-12(16)6-8-18-13/h3-6,8-9H,7H2,1-2H3 |
| Standard InCHIKey | IGWDEVSBEKYORK-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 68081 ZINC ID: ZINC000000296185 ChEMBL ID: CHEMBL448060 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC88445] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Angelica gigas | Angelica | Apiaceae |
  |
| Vepris nobilis | Vepris | Rutaceae |
|
| Heracleum maximum | Heracleum | Apiaceae |
|
| Changium smyrnioides | Changium | Apiaceae |
|
| Angelica sinensis | Angelica | Apiaceae |
|
| Convallaria majalis | Convallaria | Asparagaceae |
|
| Citrus medica | Citrus | Rutaceae |
|
| Niphogeton ternata | Niphogeton | Apiaceae | |
| Macrococculus pomiferus | Macrococculus | Menispermaceae | |
| Citrus wilsonii | Citrus | Rutaceae |
|
| Zanthoxylum spinosum | Zanthoxylum | Rutaceae | |
| Peucedanum japonicum | Peucedanum | Apiaceae |
|
| Saposhnikovia divaricata | Saposhnikovia | Apiaceae |
|
| Rabdosia angustifolia | Isodon | Lamiaceae | |
| Rhododendron dauricum | Rhododendron | Ericaceae |
|
| Smilax bracteata | Smilax | Smilacaceae |
|
| Angelica pubescens | Angelica | Apiaceae |
|
| Tynanthus panurensis | Tynanthus | Bignoniaceae | |
| Hansenia weberbaueriana | Hansenia | Apiaceae | |
| Hansenia forbesii | Hansenia | Apiaceae | |
| Angelica dahurica | Angelica | Apiaceae |
|
| Scutellaria sieberi | Scutellaria | Lamiaceae | |
| Christisonia bicolor | Christisonia | Orobanchaceae | |
| Atroxima liberica | Atroxima | Polygalaceae | |
| Linum crispum | Linum | Linaceae | |
| Palafoxia texana | Palafoxia | Asteraceae | |
| Sanguisorba officinalis | Sanguisorba | Rosaceae |
|
| Citrus maxima | Citrus | Rutaceae |
|
| Angelica acutiloba | Angelica | Apiaceae |
|
| Ostericum grosseserratum | Ostericum | Apiaceae |
|
| Citrus hystrix | Citrus | Rutaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Aralia continentalis | Aralia | Araliaceae |
|
| Angelica furcijuga | Angelica | Apiaceae |
|
| Ruta graveolens | Ruta | Rutaceae |
|
| Lawsonia inermis | Lawsonia | Lythraceae |
|
| Catharanthus roseus | Catharanthus | Apocynaceae |
|
| Petroselinum crispum | Petroselinum | Apiaceae |
 |
| Peucedanum ostruthium | Peucedanum | Apiaceae |
|
| Angelica officinalis | Angelica | Apiaceae |
|
| Bergenia crassifolia | Bergenia | Saxifragaceae |
|
| Pseudocinchona pachyceras | Pseudocinchona | Rubiaceae | |
| Angelica taiwaniana | Angelica | Apiaceae |
|
| Angelica japonica | Angelica | Apiaceae |
|
| Licaria brasiliensis | Licaria | Lauraceae | |
| Crotalaria orixensis | Crotalaria | Fabaceae |
|
| Glehnia littoralis | Glehnia | Apiaceae |
|
| Gardenia jasminoides | Gardenia | Rubiaceae |
 |
Ingredient ID: NPC74539
Formula: C12H8O4
Ingredient ID: NPC74539
| Common Name | Bergapten |
| IUPAC Name | 4-methoxyfuro[3,2-g]chromen-7-one |
| Canonical SMILES | COc1c2ccc(=O)oc2cc2c1cco2 |
| Standard InCHI | InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3 |
| Standard InCHIKey | BGEBZHIAGXMEMV-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 2355 ZINC ID: ZINC000000057731 ChEMBL ID: CHEMBL24171 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC74539] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Pinus krempfii | Pinus | Pinaceae | |
| Zanthoxylum echinocarpum | Zanthoxylum | Rutaceae |
|
| Angelica gigas | Angelica | Apiaceae |
|
| Coussarea paniculata | Coussarea | Rubiaceae | |
| Trixis inula | Trixis | Asteraceae | |
| Torilis japonica | Torilis | Apiaceae |
|
| Heracleum maximum | Heracleum | Apiaceae |
|
| Rhodomyrtus tomentosa | Rhodomyrtus | Myrtaceae |
|
| Sauropus quadrangularis | Sauropus | Phyllanthaceae |
|
| Changium smyrnioides | Changium | Apiaceae |
|
| Nierembergia hippomanica | Nierembergia | Solanaceae |
|
| Angelica decursiva | Angelica | Apiaceae |
|
| Angelica sinensis | Angelica | Apiaceae |
|
| Cnidium monnieri | Cnidium | Apiaceae |
|
| Espeletiopsis purpurascens | Espeletiopsis | Asteraceae | |
| Citrus medica | Citrus | Rutaceae |
|
| Macrococculus pomiferus | Macrococculus | Menispermaceae | |
| Citrus wilsonii | Citrus | Rutaceae |
|
| Zanthoxylum spinosum | Zanthoxylum | Rutaceae | |
| Peucedanum japonicum | Peucedanum | Apiaceae |
|
| Saposhnikovia divaricata | Saposhnikovia | Apiaceae |
|
| Amomum reticulatum | Amomum | Zingiberaceae | |
| Santalum album | Santalum | Santalaceae |
|
| Solanum torvum | Solanum | Solanaceae |
|
| Spilanthes ocymifolia | Spilanthes | Asteraceae | |
| Vernonia echitifolia | Vernonia | Asteraceae | |
| Juglans regia | Juglans | Juglandaceae |
|
| Eucalyptus exserta | Eucalyptus | Myrtaceae | |
| Inga paterno | Inga | Fabaceae |
|
| Arnica foliosa | Arnica | Asteraceae | |
| Palicourea alpina | Palicourea | Rubiaceae | |
| Plectranthus hereroensis | Plectranthus | Lamiaceae | |
| Lupinus formosus | Lupinus | Fabaceae | |
| Wunderlichia mirabilis | Wunderlichia | Asteraceae | |
| Posoqueria latifolia | Posoqueria | Rubiaceae |
|
| Dicliptera riparia | Dicliptera | Acanthaceae |
|
| Oxandra xylopioides | Oxandra | Annonaceae | |
| Ilex kaushue | Ilex | Aquifoliaceae |
|
| Garcinia parvifolia | Garcinia | Clusiaceae |
|
| Dalbergia frutescens | Dalbergia | Fabaceae | |
| Phytolacca acinosa | Phytolacca | Phytolaccaceae |
|
| Colchicum macedonicum | Colchicum | Colchicaceae | |
| Euphorbia caducifolia | Euphorbia | Euphorbiaceae |
|
| Boronia muelleri | Boronia | Rutaceae | |
| Coprosma acerosa | Coprosma | Rubiaceae |
|
| Astilbe koreana | Astilbe | Saxifragaceae | |
| Angelica keiskei | Angelica | Apiaceae |
|
| Solanum lycopersicum | Solanum | Solanaceae |
|
| Scrophularia smithii | Scrophularia | Scrophulariaceae | |
| Artemisia dracunculus | Artemisia | Asteraceae |
|
| Anethum graveolens | Anethum | Apiaceae |
|
| Hypericum papuanum | Hypericum | Hypericaceae |
|
| Zilla spinosa | Zilla | Brassicaceae |
|
| Kaunia arbuscularis | Kaunia | Asteraceae | |
| Trifolium pratense | Trifolium | Fabaceae |
|
| Ophioglossum petiolatum | Ophioglossum | Ophioglossaceae | |
| Sambucus ebulus | Sambucus | Adoxaceae |
|
| Ficus carica | Ficus | Moraceae |
|
| Angelica pubescens | Angelica | Apiaceae |
|
| Inula thapsoides | Inula | Asteraceae | |
| Tylophora flava | Tylophora | Apocynaceae | |
| Limeum pterocarpum | Limeum | Limeaceae | |
| Trifolium alexandrium | Trifolium | Fabaceae |
|
| Coptis deltoidea | Coptis | Ranunculaceae |
|
| Cassia carnaval | Cassia | Fabaceae | |
| Salix sieboldiana | Salix | Salicaceae | |
| Maclura cochinchinensis | Maclura | Moraceae |
|
| Caralluma russeliana | Caralluma | Apocynaceae | |
| Dalbergia monetaria | Dalbergia | Fabaceae |
|
| Leonurus japonicus | Leonurus | Lamiaceae |
|
| Ursinia anthemoides | Ursinia | Asteraceae | |
| Imperata cylindrica | Imperata | Poaceae |
|
| Polypodium aureum | Polypodium | Polypodiaceae | |
| Alpinia officinarum | Alpinia | Zingiberaceae |
|
| Hansenia weberbaueriana | Hansenia | Apiaceae | |
| Casimiroa edulis | Casimiroa | Rutaceae |
|
| Helianthus californicus | Helianthus | Asteraceae | |
| Hymenocallis speciosa | Hymenocallis | Amaryllidaceae | |
| Oyedaea verbesinoides | Oyedaea | Asteraceae | |
| Hansenia forbesii | Hansenia | Apiaceae | |
| Dillenia papuana | Dillenia | Dilleniaceae | |
| Angelica dahurica | Angelica | Apiaceae |
|
| Boenninghausenia albiflora | Boenninghausenia | Rutaceae |
|
| Hydrocotyle leucocephala | Hydrocotyle | Araliaceae | |
| Pyrola calliantha | Pyrola | Ericaceae |
|
| Lonchocarpus salvadorensis | Lonchocarpus | Fabaceae | |
| Levisticum officinale | Levisticum | Apiaceae |
|
| Solanum berthaultii | Solanum | Solanaceae |
|
| Daiswa dunniana | Daiswa | Melanthiaceae | |
| Citrus maxima | Citrus | Rutaceae |
|
| Schenkia spicata | Schenkia | Gentianaceae |
|
| Astragalus zahlbruckneri | Astragalus | Fabaceae | |
| Angelica acutiloba | Angelica | Apiaceae |
|
| Cranfillia vulcanica | Cranfillia | Blechnaceae | |
| Ostericum grosseserratum | Ostericum | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Aralia continentalis | Aralia | Araliaceae |
|
| Orixa japonica | Orixa | Rutaceae |
|
| Angelica furcijuga | Angelica | Apiaceae |
|
| Ruta graveolens | Ruta | Rutaceae |
|
| Peucedanum praeruptorum | Peucedanum | Apiaceae |
|
| Tanacetum santolinoides | Tanacetum | Asteraceae |
|
| Persicaria thunbergii | Persicaria | Polygonaceae |
|
| Salvia oxyodon | Salvia | Lamiaceae | |
| Phegopteris subaurita | Phegopteris | Thelypteridaceae | |
| Quercus sessilis | Quercus | Fagaceae | |
| Angelica officinalis | Angelica | Apiaceae |
|
| Salvia xalapensis | Salvia | Lamiaceae | |
| Echium italicum | Echium | Boraginaceae |
|
| Toddalia asiatica | Toddalia | Rutaceae |
|
| Citrus aurantium | Citrus | Rutaceae |
|
| Ligularia pleurocaulis | Ligularia | Asteraceae | |
| Spiraea prunifolia | Spiraea | Rosaceae |
|
| Antidesma membranaceum | Antidesma | Phyllanthaceae |
|
| Agathis macrophylla | Agathis | Araucariaceae |
|
| Angelica taiwaniana | Angelica | Apiaceae |
|
| Ficus elastica | Ficus | Moraceae |
|
| Zanthoxylum schinifolium | Zanthoxylum | Rutaceae |
|
| Kniphofia tuckii | Kniphofia | Asphodelaceae | |
| Glehnia littoralis | Glehnia | Apiaceae |
|
| Cnidium monieri | Cnidium | Apiaceae | |
| Patrinia villosa | Patrinia | Caprifoliaceae |
|
| Acanthus montanus | Acanthus | Acanthaceae |
|
| Rosa transmorrisonensis | Rosa | Rosaceae |
Ingredient ID: NPC67450
Formula: C17H16O5
Ingredient ID: NPC67450
| Common Name | n.a. |
| IUPAC Name | 9-methoxy-4-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one |
| Canonical SMILES | COc1c2occc2c(c2c1oc(=O)cc2)OCC=C(C)C |
| Standard InCHI | InChI=1S/C17H16O5/c1-10(2)6-8-20-14-11-4-5-13(18)22-16(11)17(19-3)15-12(14)7-9-21-15/h4-7,9H,8H2,1-3H3 |
| Standard InCHIKey | NNDOCYLWULORAM-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 821449 ZINC ID: ZINC000000338330 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC67450] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Vepris nobilis | Vepris | Rutaceae |
|
| Convallaria majalis | Convallaria | Asparagaceae |
|
| Peucedanum japonicum | Peucedanum | Apiaceae |
|
| Knoxia valerianoides | Knoxia | Rubiaceae |
|
| Rabdosia angustifolia | Isodon | Lamiaceae | |
| Smilax bracteata | Smilax | Smilacaceae |
|
| Angelica pubescens | Angelica | Apiaceae |
|
| Tynanthus panurensis | Tynanthus | Bignoniaceae | |
| Hansenia weberbaueriana | Hansenia | Apiaceae | |
| Hansenia forbesii | Hansenia | Apiaceae | |
| Angelica dahurica | Angelica | Apiaceae |
|
| Scutellaria sieberi | Scutellaria | Lamiaceae | |
| Christisonia bicolor | Christisonia | Orobanchaceae | |
| Atroxima liberica | Atroxima | Polygalaceae | |
| Linum crispum | Linum | Linaceae | |
| Palafoxia texana | Palafoxia | Asteraceae | |
| Sanguisorba officinalis | Sanguisorba | Rosaceae |
|
| Ostericum grosseserratum | Ostericum | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Aralia continentalis | Aralia | Araliaceae |
|
| Lawsonia inermis | Lawsonia | Lythraceae |
|
| Petroselinum crispum | Petroselinum | Apiaceae |
|
| Bergenia crassifolia | Bergenia | Saxifragaceae |
|
| Pseudocinchona pachyceras | Pseudocinchona | Rubiaceae | |
| Licaria brasiliensis | Licaria | Lauraceae | |
| Crotalaria orixensis | Crotalaria | Fabaceae |
|
| Glehnia littoralis | Glehnia | Apiaceae |
|
Ingredient ID: NPC33320
Formula: C12H8O4
Ingredient ID: NPC33320
| Common Name | Methoxsalen |
| IUPAC Name | 9-methoxyfuro[3,2-g]chromen-7-one |
| Canonical SMILES | COc1c2oc(=O)ccc2cc2c1occ2 |
| Standard InCHI | InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3 |
| Standard InCHIKey | QXKHYNVANLEOEG-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 4114 ZINC ID: ZINC000002548959 ChEMBL ID: CHEMBL416 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC33320] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Pinus krempfii | Pinus | Pinaceae | |
| Dictamnus dasycarpus | Dictamnus | Rutaceae |
|
| Zanthoxylum echinocarpum | Zanthoxylum | Rutaceae |
|
| Salta triflora | Salta | Polygonaceae | |
| Angelica gigas | Angelica | Apiaceae |
|
| Coussarea paniculata | Coussarea | Rubiaceae | |
| Eleutherococcus senticosus | Eleutherococcus | Araliaceae |
|
| Trixis inula | Trixis | Asteraceae | |
| Torilis japonica | Torilis | Apiaceae |
|
| Ambrosia arborescens | Ambrosia | Asteraceae | |
| Pleurospermum rivulorum | Pleurospermum | Apiaceae |
|
| Esenbeckia hartmanii | Esenbeckia | Rutaceae | |
| Nierembergia hippomanica | Nierembergia | Solanaceae |
|
| Pastinaca sativa | Pastinaca | Apiaceae |
|
| Angelica decursiva | Angelica | Apiaceae |
|
| Angelica sinensis | Angelica | Apiaceae |
|
| Cnidium monnieri | Cnidium | Apiaceae |
|
| Heracleum mantegazzianum | Heracleum | Apiaceae |
|
| Niphogeton ternata | Niphogeton | Apiaceae | |
| Macrococculus pomiferus | Macrococculus | Menispermaceae | |
| Zanthoxylum spinosum | Zanthoxylum | Rutaceae | |
| Peucedanum japonicum | Peucedanum | Apiaceae |
|
| Saposhnikovia divaricata | Saposhnikovia | Apiaceae |
|
| Garcinia parvifolia | Garcinia | Clusiaceae |
|
| Angelica keiskei | Angelica | Apiaceae |
|
| Ophioglossum petiolatum | Ophioglossum | Ophioglossaceae | |
| Angelica pubescens | Angelica | Apiaceae |
|
| Heracleum sphondylium | Heracleum | Apiaceae |
|
| Leonurus japonicus | Leonurus | Lamiaceae |
|
| Hymenocallis speciosa | Hymenocallis | Amaryllidaceae | |
| Oyedaea verbesinoides | Oyedaea | Asteraceae | |
| Angelica dahurica | Angelica | Apiaceae |
|
| Hydrocotyle leucocephala | Hydrocotyle | Araliaceae | |
| Pyrola calliantha | Pyrola | Ericaceae |
|
| Lonchocarpus salvadorensis | Lonchocarpus | Fabaceae | |
| Solanum berthaultii | Solanum | Solanaceae |
|
| Schenkia spicata | Schenkia | Gentianaceae |
|
| Cirsium canum | Cirsium | Asteraceae | |
| Cullen corylifolium | Cullen | Fabaceae |
|
| Astragalus zahlbruckneri | Astragalus | Fabaceae | |
| Angelica acutiloba | Angelica | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Aralia continentalis | Aralia | Araliaceae |
|
| Trifolium montanum | Trifolium | Fabaceae | |
| Ruta graveolens | Ruta | Rutaceae |
|
| Peucedanum praeruptorum | Peucedanum | Apiaceae |
|
| Ageratina saltillensis | Ageratina | Asteraceae | |
| Ajania fastigiata | Ajania | Asteraceae | |
| Angelica archangelica | Angelica | Apiaceae |
|
| Quercus sessilis | Quercus | Fagaceae | |
| Podocarpus henckelii | Podocarpus | Podocarpaceae | |
| Angelica officinalis | Angelica | Apiaceae |
|
| Ammi majus | Ammi | Apiaceae |
|
| Salvia polystachya | Salvia | Lamiaceae |
|
| Ligularia pleurocaulis | Ligularia | Asteraceae | |
| Antidesma membranaceum | Antidesma | Phyllanthaceae |
|
| Grewia villosa | Grewia | Malvaceae |
|
| Opuntia vulgaris | Opuntia | Cactaceae |
|
| Angelica taiwaniana | Angelica | Apiaceae |
|
| Kniphofia tuckii | Kniphofia | Asphodelaceae | |
| Glehnia littoralis | Glehnia | Apiaceae |
|
| Cnidium monieri | Cnidium | Apiaceae | |
| Piper hancei | Piper | Piperaceae |
|
| Patrinia villosa | Patrinia | Caprifoliaceae |
|
| Acanthus montanus | Acanthus | Acanthaceae |
|
| Rosa transmorrisonensis | Rosa | Rosaceae | |
| Annona haematantha | Annona | Annonaceae | |
| Salvia lasiantha | Salvia | Lamiaceae |
Ingredient ID: NPC281835
Formula: C12H8O5
Ingredient ID: NPC281835
| Common Name | n.a. |
| IUPAC Name | 9-hydroxy-4-methoxyfuro[3,2-g]chromen-7-one |
| Canonical SMILES | COc1c2ccc(=O)oc2c(c2c1cco2)O |
| Standard InCHI | InChI=1S/C12H8O5/c1-15-10-6-2-3-8(13)17-12(6)9(14)11-7(10)4-5-16-11/h2-5,14H,1H3 |
| Standard InCHIKey | MVJHUMZXIJPVHV-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 3083726 ZINC ID: ZINC000013322992 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC281835] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Espeletiopsis purpurascens | Espeletiopsis | Asteraceae | |
| Citrus medica | Citrus | Rutaceae |
|
| Zanthoxylum spinosum | Zanthoxylum | Rutaceae | |
| Amomum reticulatum | Amomum | Zingiberaceae | |
| Plectranthus hereroensis | Plectranthus | Lamiaceae | |
| Caralluma russeliana | Caralluma | Apocynaceae | |
| Dalbergia monetaria | Dalbergia | Fabaceae |
|
| Ursinia anthemoides | Ursinia | Asteraceae | |
| Imperata cylindrica | Imperata | Poaceae |
|
| Polypodium aureum | Polypodium | Polypodiaceae | |
| Alpinia officinarum | Alpinia | Zingiberaceae |
|
| Casimiroa edulis | Casimiroa | Rutaceae |
|
| Helianthus californicus | Helianthus | Asteraceae | |
| Angelica dahurica | Angelica | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Spiraea prunifolia | Spiraea | Rosaceae |
|
| Angelica taiwaniana | Angelica | Apiaceae |
|
Ingredient ID: NPC243509
Formula: C16H14O4
Ingredient ID: NPC243509
| Common Name | Pentosalen |
| IUPAC Name | 9-(3-methylbut-2-enoxy)furo[3,2-g]chromen-7-one |
| Canonical SMILES | CC(=CCOc1c2occc2cc2c1oc(=O)cc2)C |
| Standard InCHI | InChI=1S/C16H14O4/c1-10(2)5-7-19-16-14-12(6-8-18-14)9-11-3-4-13(17)20-15(11)16/h3-6,8-9H,7H2,1-2H3 |
| Standard InCHIKey | OLOOJGVNMBJLLR-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 10212 ZINC ID: ZINC000000001904 ChEMBL ID: CHEMBL453805 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC243509] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Pinus krempfii | Pinus | Pinaceae | |
| Zanthoxylum echinocarpum | Zanthoxylum | Rutaceae |
|
| Eleutherococcus senticosus | Eleutherococcus | Araliaceae |
|
| Trixis inula | Trixis | Asteraceae | |
| Torilis japonica | Torilis | Apiaceae |
|
| Ambrosia arborescens | Ambrosia | Asteraceae | |
| Pleurospermum rivulorum | Pleurospermum | Apiaceae |
|
| Sauropus quadrangularis | Sauropus | Phyllanthaceae |
|
| Changium smyrnioides | Changium | Apiaceae |
|
| Angelica decursiva | Angelica | Apiaceae |
|
| Angelica sinensis | Angelica | Apiaceae |
|
| Cnidium monnieri | Cnidium | Apiaceae |
|
| Citrus medica | Citrus | Rutaceae |
|
| Heracleum mantegazzianum | Heracleum | Apiaceae |
|
| Niphogeton ternata | Niphogeton | Apiaceae | |
| Macrococculus pomiferus | Macrococculus | Menispermaceae | |
| Citrus wilsonii | Citrus | Rutaceae |
|
| Zanthoxylum spinosum | Zanthoxylum | Rutaceae | |
| Peucedanum japonicum | Peucedanum | Apiaceae |
|
| Saposhnikovia divaricata | Saposhnikovia | Apiaceae |
|
| Peucedanum rubricaule | Peucedanum | Apiaceae |
|
| Spilanthes ocymifolia | Spilanthes | Asteraceae | |
| Vernonia echitifolia | Vernonia | Asteraceae | |
| Juglans regia | Juglans | Juglandaceae |
|
| Eucalyptus exserta | Eucalyptus | Myrtaceae | |
| Inga paterno | Inga | Fabaceae |
|
| Arnica foliosa | Arnica | Asteraceae | |
| Rubus idaeus | Rubus | Rosaceae |
|
| Citrus sinensis | Citrus | Rutaceae |
|
| Garcinia parvifolia | Garcinia | Clusiaceae |
|
| Citrus trifoliata | Citrus | Rutaceae |
|
| Angelica pubescens | Angelica | Apiaceae |
|
| Leonurus japonicus | Leonurus | Lamiaceae |
|
| Hansenia weberbaueriana | Hansenia | Apiaceae | |
| Hansenia forbesii | Hansenia | Apiaceae | |
| Angelica dahurica | Angelica | Apiaceae |
|
| Murraya paniculata | Murraya | Rutaceae |
|
| Citrus maxima | Citrus | Rutaceae |
|
| Schenkia spicata | Schenkia | Gentianaceae |
|
| Cirsium canum | Cirsium | Asteraceae | |
| Thamnosma rhodesica | Thamnosma | Rutaceae | |
| Ostericum grosseserratum | Ostericum | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Aralia continentalis | Aralia | Araliaceae |
|
| Orixa japonica | Orixa | Rutaceae |
|
| Angelica furcijuga | Angelica | Apiaceae |
|
| Peucedanum praeruptorum | Peucedanum | Apiaceae |
|
| Citrus natsudaidai | Citrus | Rutaceae |
|
| Phegopteris subaurita | Phegopteris | Thelypteridaceae | |
| Peucedanum ostruthium | Peucedanum | Apiaceae |
|
| Ajania fastigiata | Ajania | Asteraceae | |
| Quercus sessilis | Quercus | Fagaceae | |
| Podocarpus henckelii | Podocarpus | Podocarpaceae | |
| Angelica officinalis | Angelica | Apiaceae |
|
| Citrus aurantium | Citrus | Rutaceae |
|
| Antidesma membranaceum | Antidesma | Phyllanthaceae |
|
| Opuntia vulgaris | Opuntia | Cactaceae |
|
| Angelica taiwaniana | Angelica | Apiaceae |
|
| Kniphofia tuckii | Kniphofia | Asphodelaceae | |
| Glehnia littoralis | Glehnia | Apiaceae |
|
| Cnidium monieri | Cnidium | Apiaceae | |
| Piper hancei | Piper | Piperaceae |
|
| Patrinia villosa | Patrinia | Caprifoliaceae |
|
| Acanthus montanus | Acanthus | Acanthaceae |
|
| Rosa transmorrisonensis | Rosa | Rosaceae | |
| Gardenia jasminoides | Gardenia | Rubiaceae |
|
| Annona haematantha | Annona | Annonaceae | |
| Salvia lasiantha | Salvia | Lamiaceae |
Ingredient ID: NPC164269
Formula: C24H26O7
Ingredient ID: NPC164269
| Common Name | Praeruptorin B |
| IUPAC Name | [8,8-dimethyl-9-[(E)-2-methylbut-2-enoyl]oxy-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] (E)-2-methylbut-2-enoate |
| Canonical SMILES | C/C=C(/C(=O)OC1c2c(ccc3c2oc(=O)cc3)OC(C1OC(=O)/C(=C/C)/C)(C)C)C |
| Standard InCHI | InChI=1S/C24H26O7/c1-7-13(3)22(26)29-20-18-16(11-9-15-10-12-17(25)28-19(15)18)31-24(5,6)21(20)30-23(27)14(4)8-2/h7-12,20-21H,1-6H3/b13-7+,14-8+ |
| Standard InCHIKey | PNTWXEIQXBRCPS-FNCQTZNRSA-N |
| Ingredient External Links |
PubChem CID: 5319259 ChEMBL ID: CHEMBL3596578 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC164269] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Angelica decursiva | Angelica | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Peucedanum praeruptorum | Peucedanum | Apiaceae |
|
Ingredient ID: NPC15819
Formula: C11H6O4
Ingredient ID: NPC15819
| Common Name | Xanthotoxol |
| IUPAC Name | 9-hydroxyfuro[3,2-g]chromen-7-one |
| Canonical SMILES | O=c1ccc2c(o1)c(O)c1c(c2)cco1 |
| Standard InCHI | InChI=1S/C11H6O4/c12-8-2-1-6-5-7-3-4-14-10(7)9(13)11(6)15-8/h1-5,13H |
| Standard InCHIKey | JWVYQQGERKEAHW-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 65090 ChEMBL ID: CHEMBL1192 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC15819] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Torilis japonica | Torilis | Apiaceae |
|
| Pastinaca sativa | Pastinaca | Apiaceae |
|
| Cnidium monnieri | Cnidium | Apiaceae |
|
| Zanthoxylum spinosum | Zanthoxylum | Rutaceae | |
| Peucedanum japonicum | Peucedanum | Apiaceae |
|
| Peucedanum rubricaule | Peucedanum | Apiaceae |
|
| Angelica dahurica | Angelica | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Angelica archangelica | Angelica | Apiaceae |
|
| Angelica officinalis | Angelica | Apiaceae |
|
| Glehnia littoralis | Glehnia | Apiaceae |
|
| Cnidium monieri | Cnidium | Apiaceae |
Ingredient ID: NPC107244
Formula: C17H16O6
Ingredient ID: NPC107244
| Common Name | n.a. |
| IUPAC Name | 9-(2-hydroxy-3-methylbut-3-enoxy)-4-methoxyfuro[3,2-g]chromen-7-one |
| Canonical SMILES | COc1c2ccoc2c(c2c1ccc(=O)o2)OCC(C(=C)C)O |
| Standard InCHI | InChI=1S/C17H16O6/c1-9(2)12(18)8-22-17-15-11(6-7-21-15)14(20-3)10-4-5-13(19)23-16(10)17/h4-7,12,18H,1,8H2,2-3H3 |
| Standard InCHIKey | UBAMGTKSOKGECF-UHFFFAOYSA-N |
| Ingredient External Links |
PubChem CID: 616064 |
| Plant-Ingredient Association Reference |
Database: NPASS [NPC107244] |
Distribution of the ingredient across plants
| Plant Name | Plant Genus | Plant Family | Plant Usage |
|---|---|---|---|
| Buddleja officinalis | Buddleja | Scrophulariaceae |
|
| Angelica dahurica | Angelica | Apiaceae |
|
| Angelica talwaniana | Angelica | Apiaceae | |
| Angelica taiwaniana | Angelica | Apiaceae |
|
Properties
| Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| NPC107244 | C17H16O6 | 316.0946882 | 0.5648 | 2.67 | 1.106 | 2 | 1 | 78.13 | 8 | 3 | 23 | 0 | |
| NPC15819 | C11H6O4 | Xanthotoxol | 202.03 | -0.3444 | 2.23 | 1.171 | 1 | 1 | 59.67 | 1 | 3 | 15 | 0 |
| NPC164269 | C24H26O7 | Praeruptorin B | 426.17 | 3.1344 | 3.33 | 4.537 | 5 | 0 | 88.13 | 12 | 3 | 31 | 0 |
| NPC243509 | C16H14O4 | Pentosalen | 270.09 | 1.5296 | 2.78 | 2.891 | 1 | 0 | 48.67 | 5 | 3 | 20 | 0 |
| NPC281835 | C12H8O5 | 232.0371734 | -0.3962 | 2.23 | 0.727 | 1 | 1 | 68.9 | 3 | 3 | 17 | 0 | |
| NPC33320 | C12H8O4 | Methoxsalen | 216.04 | 0.0641 | 2.34 | 1.69 | 1 | 0 | 48.67 | 2 | 3 | 16 | 0 |
| NPC67450 | C17H16O5 | 300.0997736 | 1.4778 | 2.78 | 2.447 | 1 | 0 | 57.9 | 7 | 3 | 22 | 0 | |
| NPC74539 | C12H8O4 | Bergapten | 216.04 | 0.0641 | 2.34 | 1.69 | 1 | 0 | 48.67 | 2 | 3 | 16 | 0 |
| NPC88445 | C16H14O4 | Isoimperatorin | 270.09 | 1.5296 | 2.78 | 2.891 | 1 | 0 | 48.67 | 5 | 3 | 20 | 0 |
Download Data
All data can be downloaded by:→ Selecting data type in the below download table
→ Then click the download button.
