3,4-Dehydrolycopen-16-al (CHEBI:228998)

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CHEBI:228998 - 3,4-Dehydrolycopen-16-al

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ChEBI ID	CHEBI:228998
ChEBI Name	3,4-Dehydrolycopen-16-al
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C40H52O
Net Charge	0
Average Mass	548.855
Monoisotopic Mass	548.40182
SMILES	CC(C)=CCC/C(C)=C/C=C/C(C)=C\C=C/C(C)=C/C=C/C=C(C)/C=C\C=C(C)/C=C/C=C(C)/C=C\C=C(/C)C=O
InChI	InChI=1S/C40H52O/c1-33(2)18-12-21-36(5)24-15-27-37(6)25-13-22-34(3)19-10-11-20-35(4)23-14-26-38(7)28-16-29-39(8)30-17-31-40(9)32-41/h10-11,13-20,22-32H,12,21H2,1-9H3/b11-10+,22-13-,23-14-,27-15+,28-16+,30-17-,34-19+,35-20+,36-24+,37-25-,38-26-,39-29+,40-31+
InChIKey	FPLASDSFNINBIY-QETLVAEPSA-N

Species of Metabolite	Component	Source	Comments
Zea mays (ncbitaxon:4577)	exometabolome	MetaboLights (MTBLS8903)

ChEBI Ontology

Outgoing Relation(s)
	3,4-Dehydrolycopen-16-al (CHEBI:228998) is a xanthophyll (CHEBI:27325)

IUPAC Name
(2E,4Z,6E,8E,10Z,12Z,14E,16E,18E,20Z,22Z,24E,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,4,6,8,10,12,14,16,18,20,22,24,26,30-tetradecaenal

Manual Xrefs	Databases
4475512	ChemSpider