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> Main
CHEBI:66739 - Peucedanone
Main
ChEBI Ontology
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ChEBI Name
Peucedanone
ChEBI ID
CHEBI:66739
Definition
A natural product found in
Angelica gigas
.
Stars
This entity has been manually annotated by a third party.
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Formula
C14H14O5
Net Charge
0
Average Mass
262.25800
Monoisotopic Mass
262.08412
InChI
InChI=1S/C14H14O5/c1-14(2,18)12(16)6-9-5-8-3-4-13(17)19-11(8)7-10(9)15/h3-5,7,15,18H,6H2,1-2H3
InChIKey
HCVVJUMQCNQCCT-UHFFFAOYSA-N
SMILES
CC(C)(O)C(=O)Cc1cc2ccc(=O)oc2cc1O
Metabolite of Species
Details
Angelica gigas
(NCBI:txid85712)
Found in root
(BTO:0001188)
. 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
Peucedanone (
CHEBI:66739
)
has role
metabolite (
CHEBI:25212
)
Peucedanone (
CHEBI:66739
)
is a
hydroxycoumarin (
CHEBI:37912
)
Synonym
Source
7-hydroxy-6-(3-hydroxy-3-methyl-2-oxobutyl)-coumarin
ChEBI
Citation
Type
Source
11374978
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:1-benzopyran(CHEBI:38443); ISA:pyranone(CHEBI:37963); ISA:phenols(CHEBI:33853); ISA:Acyloin(CHEBI:2468); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:ketone(CHEBI:17087); ISA:tertiary alcohol(CHEBI:26878); ISA:lactone(CHEBI:25000); ISA:organonitrogen compound(CHEBI:35352); ISA:aromatic alcohol(CHEBI:33854);