5-(10,13-Nonadecadienyl)-1,3-benzenediol (CHEBI:230284)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	5-(10,13-Nonadecadienyl)-1,3-benzenediol

ChEBI ID	CHEBI:230284

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C25H40O2

Net Charge

Average Mass

372.593

Monoisotopic Mass

372.30283

InChI

InChI=1S/C25H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-20-24(26)22-25(27)21-23/h6-7,9-10,20-22,26-27H,2-5,8,11-19H2,1H3/b7-6+,10-9+

InChIKey

QEMSHYYBCNAAQA-AVQMFFATSA-N

SMILES

OC1=CC(CCCCCCCCC/C=C/C\C=C\CCCCC)=CC(O)=C1

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	5-(10,13-Nonadecadienyl)-1,3-benzenediol (CHEBI:230284) is a resorcinols (CHEBI:33572)

IUPAC Name

5-[(10E,13E)-nonadeca-10,13-dienyl]benzene-1,3-diol