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CHEBI:53158 - 4'-apo-β-carotenol

ChEBI IDCHEBI:53158
ChEBI Name4'-apo-β-carotenol
Stars
ASCII Name4'-apo-beta-carotenol
DefinitionAn apo carotenoid C35 terpenoid compound arising from oxidative degradation of the β,β-carotene skeleton at the 4'-position.
Last Modified29 September 2009
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC35H48O
Net Charge0
Average Mass484.768
Monoisotopic Mass484.37052
SMILESCC1=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)CO)C(C)(C)CCC1
InChIInChI=1S/C35H48O/c1-28(17-11-19-30(3)20-13-22-32(5)27-36)15-9-10-16-29(2)18-12-21-31(4)24-25-34-33(6)23-14-26-35(34,7)8/h9-13,15-22,24-25,36H,14,23,26-27H2,1-8H3/b10-9+,17-11+,18-12+,20-13+,25-24+,28-15+,29-16+,30-19+,31-21+,32-22+
InChIKeyIRGSMWBLPRDMQW-BRZOAGJPSA-N
ChEBI Ontology
Outgoing Relation(s)
4'-apo-β-carotenol (CHEBI:53158) is a apo carotenoid C35 terpenoid (CHEBI:53185)
Registry NumbersSources
Beilstein:2571564Beilstein