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CHEBI:53154 - 8'-apo-β,ψ-caroten-8'-al

Default Structure
ChEBI IDCHEBI:53154
ChEBI Name8'-apo-β,ψ-caroten-8'-al
Stars
ASCII Name8'-apo-beta,psi-caroten-8'-al
DefinitionAn apo carotenoid triterpenoid compound arising from oxidative degradation of the β,β-carotene skeleton at the 8'-position.
Last Modified22 July 2013
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H40O
Net Charge0
Average Mass416.649
Monoisotopic Mass416.30792
SMILES[H]C(=O)/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C
InChIInChI=1S/C30H40O/c1-24(13-8-9-14-25(2)16-11-18-27(4)23-31)15-10-17-26(3)20-21-29-28(5)19-12-22-30(29,6)7/h8-11,13-18,20-21,23H,12,19,22H2,1-7H3/b9-8+,15-10+,16-11+,21-20+,24-13+,25-14+,26-17+,27-18+
InChIKeyDFMMVLFMMAQXHZ-DOKBYWHISA-N
ChEBI Ontology
Outgoing Relation(s)
8'-apo-β,ψ-caroten-8'-al (CHEBI:53154) is a apo carotenoid triterpenoid (CHEBI:36783)
8'-apo-β,ψ-caroten-8'-al (CHEBI:53154) is a enal (CHEBI:51688)
IUPAC Name 
8'-apo-β,ψ-caroten-8'-al
Synonyms  Source
8'-Apo-beta-caroten-8'-alChemIDplus
8'-Apo-beta-carotenalChemIDplus
8'Apo-beta,psi-carotenalChemIDplus
all-trans-beta-Apo-8'-carotenalChemIDplus
ApocarotenalChemIDplus
beta-Apo-8'-carotenal (C30)ChemIDplus
UniProt Name  Source
all-trans-8'-apo-β-carotenalUniProt
Registry NumbersSources
Beilstein:2064131Beilstein
CAS:1107-26-2ChemIDplus
Citations