CHEBI:60916 - corynomycolic acid

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ChEBI Name corynomycolic acid ChEBI ID CHEBI:60916 Definition A thirty-two membered mycolic acid consisting of 3-hydroxystearic acid having a tetradecyl group at the 2-position. Stars This entity has been manually annotated by the ChEBI Team. 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 C32H64O3 Net Charge 0 Average Mass 496.84880 Monoisotopic Mass 496.48555 InChI InChI=1S/C32H64O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31(33)30(32(34)35)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h30-31,33H,3-29H2,1-2H3,(H,34,35) InChIKey CUEQHYJSSUSIFI-UHFFFAOYSA-N SMILES CCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCCCCC)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing corynomycolic acid (CHEBI:60916) is a 3-hydroxy fatty acid (CHEBI:59845) corynomycolic acid (CHEBI:60916) is a mycolic acid (CHEBI:25438) Incoming 6-deoxy-D-glucos-6-yl corynomycolate (CHEBI:74256) has functional parent corynomycolic acid (CHEBI:60916) IUPAC Name 3-hydroxy-2-tetradecyloctadecanoic acid Synonyms Sources mycolic acid (C32) ChEBI synthetic mycolic acid ChEBI Manual Xref Database C16793 KEGG COMPOUND View more database links Registry Numbers Types Sources 1807083 Reaxys Registry Number Reaxys 446-21-9 CAS Registry Number KEGG COMPOUND Citations Types Sources 20519644 PubMed citation Europe PMC 3004751 PubMed citation Europe PMC 8885369 PubMed citation Europe PMC Last Modified 04 August 2014