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CHEBI:53162 - 12'-apo-β-carotenol

ChEBI IDCHEBI:53162
ChEBI Name12'-apo-β-carotenol
Stars
ASCII Name12'-apo-beta-carotenol
DefinitionAn apo carotenoid C25 terpenoid compound arising from oxidative degradation of the β,β-carotene skeleton at the 12'-position.
Last Modified29 September 2009
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC25H36O
Net Charge0
Average Mass352.562
Monoisotopic Mass352.27662
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(\C)CO)C(C)(C)CCC1
InChIInChI=1S/C25H36O/c1-20(11-7-8-12-22(3)19-26)13-9-14-21(2)16-17-24-23(4)15-10-18-25(24,5)6/h7-9,11-14,16-17,26H,10,15,18-19H2,1-6H3/b8-7+,13-9+,17-16+,20-11+,21-14+,22-12+
InChIKeyNQOXNPMIVIPDNQ-PHPDKTIJSA-N
ChEBI Ontology
Outgoing Relation(s)
12'-apo-β-carotenol (CHEBI:53162) is a apo carotenoid C25 terpenoid (CHEBI:53184)
IUPAC Name 
12'-apo-β-caroten-12'-ol
Registry NumbersSources
Beilstein:1997467Beilstein