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CHEBI:132173 - all-trans-7,8-dihydroretinol

ChEBI IDCHEBI:132173
ChEBI Nameall-trans-7,8-dihydroretinol
Stars
ASCII Nameall-trans-7,8-dihydroretinol
DefinitionA retinoid obtained by formal hydrogenation across the 7,8-double bond of all-trans-retinol
Last Modified17 September 2018
Submittersabrina, zfin
DownloadsMolfile
FormulaC20H32O
Net Charge0
Average Mass288.475
Monoisotopic Mass288.24532
SMILESCC1=C(CC/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CCC1
InChIInChI=1S/C20H32O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,13,21H,7,10-12,14-15H2,1-5H3/b9-6+,16-8+,17-13+
InChIKeyXEMSPUZLYVPKPX-SHGBQBHBSA-N
Species of MetaboliteComponentSourceComments
Danio rerio (ncbitaxon:7955) - PubMed (17253779)
Roles Classification
Biological Role:
marine xenobiotic metabolite  Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
all-trans-7,8-dihydroretinol (CHEBI:132173) has role marine xenobiotic metabolite (CHEBI:83399)
all-trans-7,8-dihydroretinol (CHEBI:132173) is a primary alcohol (CHEBI:15734)
all-trans-7,8-dihydroretinol (CHEBI:132173) is a retinoid (CHEBI:26537)
IUPAC Name 
7,8-dihydroretinol
Synonym  Source
(2E,4E,6E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6-trien-1-olIUPAC
UniProt Name  Source
all-trans-7,8-dihydroretinolUniProt
Registry NumbersSources
Reaxys:22648242Reaxys
CAS:115797-12-1ChemIDplus
Citations