CHEBI:139183 - 5,6-epoxyretinoate

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ChEBI Name 5,6-epoxyretinoate ChEBI ID CHEBI:139183 Definition A monocarboxylic acid anion that is the conjugate base of 5,6-epoxyretinoic acid arising from deprotonation of the carboxylic acid function; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C20H27O3 Net Charge -1 Average Mass 315.427 Monoisotopic Mass 315.19657 InChI InChI=1S/C20H28O3/c1-15(8-6-9-16(2)14-17(21)22)10-13-20-18(3,4)11-7-12-19(20,5)23-20/h6,8-10,13-14H,7,11-12H2,1-5H3,(H,21,22)/p-1/b9-6+,13-10+,15-8+,16-14+ InChIKey KEEHJLBAOLGBJZ-WEDZBJJJSA-M SMILES C12(C(CCCC1(C)O2)(C)C)/C=C/C(=C/C=C/C(=C/C([O-])=O)/C)/C ChEBI Ontology Outgoing 5,6-epoxyretinoate (CHEBI:139183) is a monocarboxylic acid anion (CHEBI:35757) 5,6-epoxyretinoate (CHEBI:139183) is a retinoid anion (CHEBI:139589) 5,6-epoxyretinoate (CHEBI:139183) is conjugate base of 5,6-epoxyretinoic acid (CHEBI:80658) Incoming 5,6-epoxyretinoic acid (CHEBI:80658) is conjugate acid of 5,6-epoxyretinoate (CHEBI:139183) IUPAC Name (2E,4E,6E,8E)-3,7-dimethyl-9-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)nona-2,4,6,8-tetraenoate Synonyms Sources all-trans-5,6-epoxyretinoate UniProt all-trans-5,6-epoxyretinoate ChEBI Citations Types Sources 10702251 PubMed citation SUBMITTER 7056740 PubMed citation SUBMITTER Last Modified 06 February 2018