CHEBI:15036 - retinoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name retinoate
ChEBI ID CHEBI:15036
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C20H27O2
Net Charge -1
Average Mass 299.42718
Monoisotopic Mass 299.20165
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)/p-1
InChIKey SHGAZHPCJJPHSC-UHFFFAOYSA-M
SMILES CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC([O-])=O
ChEBI Ontology
Outgoing retinoate (CHEBI:15036) is a monocarboxylic acid anion (CHEBI:35757)
retinoate (CHEBI:15036) is a retinoid anion (CHEBI:139589)
retinoate (CHEBI:15036) is conjugate base of retinoic acid (CHEBI:26536)
Incoming 11-cis-retinoate (CHEBI:87435) is a retinoate (CHEBI:15036)
13-cis-retinoate (CHEBI:169952) is a retinoate (CHEBI:15036)
9-cis-retinoate (CHEBI:78630) is a retinoate (CHEBI:15036)
all-trans-retinoate (CHEBI:35291) is a retinoate (CHEBI:15036)
retinoic acid (CHEBI:26536) is conjugate acid of retinoate (CHEBI:15036)
IUPAC Name
3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate
Synonym Source
retinoate UniProt
Last Modified
06 February 2018