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CHEBI:15035 - retinal

ChEBI IDCHEBI:15035
ChEBI Nameretinal
Stars
DefinitionAn enal that consists of 3,7-dimethyl-9-nona-2,4,6,8-tetraenal (double bond geometry unspecified) carrying a 2,6,6-trimethylcyclohex-1-en-1-yl group at the 9-position.
Last Modified13 February 2015
DownloadsMolfile
FormulaC20H28O
Net Charge0
Average Mass284.443
Monoisotopic Mass284.21402
SMILES[H]C(=O)C=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C
InChIInChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,15H,7,10,14H2,1-5H3
InChIKeyNCYCYZXNIZJOKI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
retinal (CHEBI:15035) has role human metabolite (CHEBI:77746)
retinal (CHEBI:15035) is a enal (CHEBI:51688)
retinal (CHEBI:15035) is a retinals (CHEBI:26534)
Incoming Relation(s)
all-trans-retinal (CHEBI:17898) is a retinal (CHEBI:15035)
11-cis-retinal (CHEBI:16066) is a retinal (CHEBI:15035)
13-cis-retinal (CHEBI:45487) is a retinal (CHEBI:15035)
9-cis-retinal (CHEBI:78273) is a retinal (CHEBI:15035)
IUPAC Name 
3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal
UniProt Name  Source
retinalUniProt
Manual XrefsDatabases
RetinalsMetaCyc
Registry NumbersSources
Reaxys:2055098Reaxys