CHEBI:69939 - Dentatin

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ChEBI Name Dentatin
ChEBI ID CHEBI:69939
Definition A natural product found in Clausena harmandiana.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H22O4
Net Charge 0
Average Mass 326.38630
Monoisotopic Mass 326.15181
InChI InChI=1S/C20H22O4/c1-7-19(2,3)15-17-12(8-9-14(21)23-17)16(22-6)13-10-11-20(4,5)24-18(13)15/h7-11H,1H2,2-6H3
InChIKey QBFYQVZGIDUNIY-UHFFFAOYSA-N
SMILES COc1c2C=CC(C)(C)Oc2c(c2oc(=O)ccc12)C(C)(C)C=C
Metabolite of Species Details
Clausena harmandiana (NCBI:txid159036) Found in root (BTO:0001188). Crude ethyl acetate extract of air-dried, powdered roots. 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 Dentatin (CHEBI:69939) has role metabolite (CHEBI:25212)
Dentatin (CHEBI:69939) is a coumarins (CHEBI:23403)
Synonyms Sources
10-(1,1-Dimethyl-allyl)-5-methoxy-8,8-dimethyl-8H-pyrano(3,2-g)chromen-2-one ChEBI
Poncitrin ChEBI
Registry Number Type Source
22980-57-0 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21302964 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:chromenes(CHEBI:23232); ISA:1-benzopyran(CHEBI:38443); ISA:methoxybenzene(CHEBI:51683); ISA:aromatic ether(CHEBI:35618); ISA:pyranone(CHEBI:37963); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:lactone(CHEBI:25000);