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CHEBI:16066 - 11-cis-retinal

ChEBI IDCHEBI:16066
ChEBI Name11-cis-retinal
Stars
ASCII Name11-cis-retinal
DefinitionA retinal having 2E,4Z,6E,8E-double bond geometry.
Secondary ChEBI IDsCHEBI:727, CHEBI:11311, CHEBI:19119
Last Modified27 January 2016
DownloadsMolfile
FormulaC20H28O
Net Charge0
Average Mass284.443
Monoisotopic Mass284.21402
SMILESCC1=C(/C=C/C(C)=C/C=C\C(C)=C\C=O)C(C)(C)CCC1
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/b9-6-,12-11+,16-8+,17-13+
InChIKeyNCYCYZXNIZJOKI-IOUUIBBYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
chromophore  The part (atom or group of atoms) of a molecular entity in which the electronic transition responsible for a given spectral band is approximately localized.
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
11-cis-retinal (CHEBI:16066) has role chromophore (CHEBI:23240)
11-cis-retinal (CHEBI:16066) has role human metabolite (CHEBI:77746)
11-cis-retinal (CHEBI:16066) has role mouse metabolite (CHEBI:75771)
11-cis-retinal (CHEBI:16066) is a retinal (CHEBI:15035)
Incoming Relation(s)
(3R)-11-cis-3-hydroxyretinal (CHEBI:66898) has functional parent 11-cis-retinal (CHEBI:16066)
(3S)-11-cis-3-hydroxyretinal (CHEBI:52227) has functional parent 11-cis-retinal (CHEBI:16066)
IUPAC Name 
11-cis-retinal
Synonyms  Source
11-cis-RetinalKEGG COMPOUND
11-cis-Vitamin A aldehydeKEGG COMPOUND
11-cis-RetineneKEGG COMPOUND
(2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenalIUPAC
11-cis-retinalChEBI
11-cis-retineneChEBI
UniProt Name  Source
11-cis-retinalUniProt
Manual XrefsDatabases
C02110KEGG COMPOUND
LMPR01090003LIPID MAPS
HMDB0002152HMDB
CPD-881MetaCyc
Registry NumbersSources
Reaxys:1914181Reaxys
CAS:564-87-4HMDB
Citations