The Drug Ontology

Last uploaded: November 15, 2024
Preferred Name

retinoate
Synonyms

3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate

retinoate

ID

http://purl.obolibrary.org/obo/CHEBI_15036

alternative label

3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate

retinoate

charge

-1

formula

C20H27O2

has_exact_synonym

3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate

retinoate

has_obo_namespace

chebi_ontology

id

CHEBI:15036

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

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

is conjugate base of

http://purl.obolibrary.org/obo/CHEBI_26536

label

retinoate

mass

299.42718

monoisotopicmass

299.20165

notation

CHEBI:15036

prefLabel

retinoate

smiles

CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC([O-])=O

subClassOf

http://purl.obolibrary.org/obo/CHEBI_35757

http://purl.obolibrary.org/obo/CHEBI_139589

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