CHEBI:69829 - oxypeucedanin hydrate

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ChEBI Name oxypeucedanin hydrate
ChEBI ID CHEBI:69829
Definition A natural product found in Peucedanum ostruthium.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H16O6
Net Charge 0
Average Mass 304.29460
Monoisotopic Mass 304.09469
InChI InChI=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
InChIKey PEWFWDOPJISUOK-CYBMUJFWSA-N
SMILES CC(C)(O)[C@H](O)COc1c2ccoc2cc2oc(=O)ccc12
Metabolite of Species Details
Peucedanum ostruthium (NCBI:txid1000424) Found in rhizome (BTO:0001181). Dichloromethane extract of dried, powdered roots and rhizomes See: PubMed
Peucedanum ostruthium (NCBI:txid1000424) Found in root (BTO:0001188). Dichloromethane extract of dried, powdered roots and rhizomes See: PubMed
Citrus hystrix (NCBI:txid170989) Found in exocarp (BTO:0000733). The hexane extract of dried and ground fruit peels See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing oxypeucedanin hydrate (CHEBI:69829) has role metabolite (CHEBI:25212)
oxypeucedanin hydrate (CHEBI:69829) is a furanocoumarin (CHEBI:24128)
Synonyms Sources
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2,3-dihydroxy-3-methylbutoxy)-, (R)- ChEBI
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-(2,3-dihydroxy-3-methylbutoxy)-, (R)-(+)- ChEBI
Hydroxypeucedanin hydrate ChEBI
Prangolarin hydrate ChEBI
Prawgol ChEBI
Registry Number Type Source
2643-85-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
20964319 PubMed citation Europe PMC
21627108 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:psoralens(CHEBI:26369); ISA:1-benzopyran(CHEBI:38443); ISA:benzofurans(CHEBI:35259); ISA:pyranone(CHEBI:37963); ISA:aromatic ether(CHEBI:35618); ISA:benzenoid aromatic compound(CHEBI:33836); ISA:furans(CHEBI:24129); ISA:tertiary alcohol(CHEBI:26878); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:lactone(CHEBI:25000); ISA:secondary alcohol(CHEBI:35681); ISA:polyol(CHEBI:26191);