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CHEBI:32095 - retinyl acetate

ChEBI IDCHEBI:32095
ChEBI Nameretinyl acetate
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC22H32O2
Net Charge0
Average Mass328.496
Monoisotopic Mass328.24023
SMILESCC(=O)OC/C=C(C)/C=C/C=C(C)/C=C/C1=C(C)CCCC1(C)C
InChIInChI=1S/C22H32O2/c1-17(9-7-10-18(2)14-16-24-20(4)23)12-13-21-19(3)11-8-15-22(21,5)6/h7,9-10,12-14H,8,11,15-16H2,1-6H3/b10-7+,13-12+,17-9+,18-14+
InChIKeyQGNJRVVDBSJHIZ-QHLGVNSISA-N
ChEBI Ontology
Outgoing Relation(s)
retinyl acetate (CHEBI:32095) has functional parent all-trans-retinol (CHEBI:17336)
retinyl acetate (CHEBI:32095) is a acetate ester (CHEBI:47622)
IUPAC Name 
(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl acetate
Synonyms  Source
O15-acetylretinolChEBI
Retinol acetateKEGG DRUG
all-trans-Vitamin A acetateChemIDplus
all-trans-Retinyl acetateChemIDplus
all-trans-Retinol acetateChemIDplus
Vitamin A alcohol acetateNIST Chemistry WebBook
Manual XrefsDatabases
D01621KEGG DRUG
LMPR01090012LIPID MAPS
2372DrugCentral
Registry NumbersSources
Beilstein:1915439Beilstein
CAS:127-47-9ChemIDplus