all-trans-3,4-didehydroretinol (CHEBI:132246)

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ChEBI Name	all-trans-3,4-didehydroretinol

ChEBI ID	CHEBI:132246

ChEBI ASCII Name	all-trans-3,4-didehydroretinol

Definition	A retinoid derived from 3,4-desaturation of the β-ionone ring of all-trans-retinol.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Nevila Nouspikel

Supplier Information

Download	Molfile XML SDF

Formula

C20H28O

Net Charge

Average Mass

284.436

Monoisotopic Mass

284.21402

InChI

InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6-13,21H,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+

InChIKey

XWCYDHJOKKGVHC-OVSJKPMPSA-N

SMILES

C1(C)(C)C(\C=C\C(=C\C=C\C(=C\CO)\C)\C)=C(C)C=CC1

Roles Classification
Biological Role(s):	mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. marine xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via vitamin A ) fat-soluble vitamin (role) Any vitamin that dissolves in fats and are stored in body tissues. Unlike the water-soluble vitamins, they are stored in the body for long periods of time and generally pose a greater risk for toxicity when consumed in excess. (via vitamin A )

ChEBI Ontology
Outgoing	all-trans-3,4-didehydroretinol (CHEBI:132246) has functional parent all-trans-retinol (CHEBI:17336) all-trans-3,4-didehydroretinol (CHEBI:132246) has role human xenobiotic metabolite (CHEBI:76967) all-trans-3,4-didehydroretinol (CHEBI:132246) has role marine xenobiotic metabolite (CHEBI:83399) all-trans-3,4-didehydroretinol (CHEBI:132246) has role mouse metabolite (CHEBI:75771) all-trans-3,4-didehydroretinol (CHEBI:132246) is a retinoid (CHEBI:26537) all-trans-3,4-didehydroretinol (CHEBI:132246) is a vitamin A (CHEBI:12777)

Incoming	all-trans-3,4-didehydro-13,14-dihydroretinol (CHEBI:142226) has functional parent all-trans-3,4-didehydroretinol (CHEBI:132246)

IUPAC Name

3,4-didehydroretinol

Synonyms	Sources
(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraen-1-ol	IUPAC
3,4-didehydro-all-trans-retinol	ChemIDplus
3,4-didehydro-retinol	LIPID MAPS
3-dehydoretinol	ChemIDplus
all-trans-3,4-didehydroretinol	UniProt
all-trans-3-Dehydroretinol	HMDB
dehydroretinol	ChemIDplus
vitamin A2	ChemIDplus
vitamin A₂	ChEBI

Last Modified

28 July 2021