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CHEBI:194189 - all-trans-13,14-dihydroretinoic acid

ChEBI IDCHEBI:194189
ChEBI Nameall-trans-13,14-dihydroretinoic acid
Stars
ASCII Nameall-trans-13,14-dihydroretinoic acid
Last Modified9 March 2023
SubmitterAdnan
DownloadsMolfile
FormulaC20H30O2
Net Charge0
Average Mass302.458
Monoisotopic Mass302.22458
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)CC(=O)O)C(C)(C)CCC1
InChIInChI=1S/C20H30O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,16H,7,10,13-14H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+
InChIKeyXTOYXKSKSDVOOD-CISKFWAASA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
all-trans-13,14-dihydroretinoic acid (CHEBI:194189) has functional parent all-trans-retinoic acid (CHEBI:15367)
all-trans-13,14-dihydroretinoic acid (CHEBI:194189) is a monocarboxylic acid (CHEBI:25384)
all-trans-13,14-dihydroretinoic acid (CHEBI:194189) is a retinoid (CHEBI:26537)
all-trans-13,14-dihydroretinoic acid (CHEBI:194189) is conjugate acid of all-trans-13,14-dihydroretinoate (CHEBI:194183)
Incoming Relation(s)
4-hydroxy-all-trans-13,14-dihydroretinoic acid (CHEBI:194479) has functional parent all-trans-13,14-dihydroretinoic acid (CHEBI:194189)
all-trans-13,14-dihydroretinoate (CHEBI:194183) is conjugate base of all-trans-13,14-dihydroretinoic acid (CHEBI:194189)
IUPAC Name 
13,14-dihydroretinoic acid
Synonym  Source
(4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-4,6,8-trienoic acidIUPAC
Citations