CHEBI:94695 - acetic acid [3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name acetic acid [3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] ester
ChEBI ID CHEBI:94695
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H32O2
Net Charge 0
Average Mass 328.489
Monoisotopic Mass 328.24023
InChI InChI=1S/C22H32O2/c1-17(9-7-10-18(2)14-16-24-20(4)23)12-13-21-19(3)11-8-15-22(21,5)6/h7,9-10,12-14H,8,11,15-16H2,1-6H3
InChIKey QGNJRVVDBSJHIZ-UHFFFAOYSA-N
SMILES CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCOC(=O)C)C)C
ChEBI Ontology
Outgoing acetic acid [3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] ester (CHEBI:94695) is a retinoid (CHEBI:26537)
Manual Xref Database
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