Terminology Service for NFDI4Health
JSON

retinoic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_26536

A retinoid consisting of 3,7-dimethylnona-2,4,6,8-tetraenoic acid substituted at position 9 by a 2,6,6-trimethylcyclohex-1-en-1-yl group (geometry of the four exocyclic double bonds is not specified).

Term info

Label

retinoic acid

Synonyms
  • 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid [ IUPAC ]

charge

0

formula

C20H28O2

has obo namespace

chebi_ontology

id

CHEBI:26536

inchi

InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)

inchikey

SHGAZHPCJJPHSC-UHFFFAOYSA-N

mass

300.43512

monoisotopicmass

300.20893

smiles

CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC(O)=O