2-(1',5'-heptadienyl)-3,6-dihydroxy-5-(3"-methyl-2"-butenyl)benzaldehyde (CHEBI:197614)

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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	2-(1',5'-heptadienyl)-3,6-dihydroxy-5-(3"-methyl-2"-butenyl)benzaldehyde

ChEBI ID	CHEBI:197614

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C19H24O3

Net Charge

Average Mass

300.398

Monoisotopic Mass

300.17254

InChI

InChI=1S/C19H24O3/c1-4-5-6-7-8-9-16-17(13-20)19(22)15(12-18(16)21)11-10-14(2)3/h4-5,8-10,12-13,21-22H,6-7,11H2,1-3H3/b5-4+,9-8+

InChIKey

YMWWYKZCNJAKQU-KQWYESAVSA-N

SMILES

O=CC1=C(O)C(=CC(=C1/C=C/CC/C=C/C)O)CC=C(C)C

Metabolite of Species	Details
Aspergillus ruber (NCBI:txid396024)	See: PubMed

ChEBI Ontology
Outgoing	2-(1',5'-heptadienyl)-3,6-dihydroxy-5-(3"-methyl-2"-butenyl)benzaldehyde (CHEBI:197614) is a hydroquinones (CHEBI:24646)

IUPAC Name

2-[(1E,5E)-hepta-1,5-dienyl]-3,6-dihydroxy-5-(3-methylbut-2-enyl)benzaldehyde