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CHEBI:69829 - oxypeucedanin hydrate

ChEBI IDCHEBI:69829
ChEBI Nameoxypeucedanin hydrate
Stars
DefinitionA natural product found in Peucedanum ostruthium.
Last Modified22 September 2014
DownloadsMolfile
FormulaC16H16O6
Net Charge0
Average Mass304.298
Monoisotopic Mass304.09469
SMILESCC(C)(O)[C@H](O)COc1c2ccoc2cc2oc(=O)ccc12
InChIInChI=1S/C16H16O6/c1-16(2,19)13(17)8-21-15-9-3-4-14(18)22-12(9)7-11-10(15)5-6-20-11/h3-7,13,17,19H,8H2,1-2H3/t13-/m1/s1
InChIKeyPEWFWDOPJISUOK-CYBMUJFWSA-N
Species of MetaboliteComponentSourceComments
Peucedanum ostruthium (ncbitaxon:1000424)
root (BTO:0001188) PubMed (21627108) Dichloromethane extract of dried, powdered roots and rhizomes
rhizome (BTO:0001181) PubMed (21627108) Dichloromethane extract of dried, powdered roots and rhizomes
Citrus hystrix (ncbitaxon:170989) exocarp (BTO:0000733) PubMed (20964319) The hexane extract of dried and ground fruit peels
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
oxypeucedanin hydrate (CHEBI:69829) has role metabolite (CHEBI:25212)
oxypeucedanin hydrate (CHEBI:69829) is a furanocoumarin (CHEBI:24128)
Synonyms  Source
Hydroxypeucedanin hydrateChEBI
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2,3-dihydroxy-3-methylbutoxy)-, (R)-ChEBI
Prangolarin hydrateChEBI
PrawgolChEBI
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2,3-dihydroxy-3-methylbutoxy)-, (R)-(+)-ChEBI
Registry NumbersSources
CAS:2643-85-8ChemIDplus
Citations