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CHEBI:74256 - 6-deoxy-D-glucos-6-yl corynomycolate

ChEBI IDCHEBI:74256
ChEBI Name6-deoxy-D-glucos-6-yl corynomycolate
Stars
ASCII Name6-deoxy-D-glucos-6-yl corynomycolate
DefinitionA mycolate ester formed by esterification of corynomycolic acid with the 6-OH of D-glucose. (C32 is the average tail length of a reported naturally occurring range of 30-36 carbon atoms.)
Last Modified9 August 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC38H74O8
Net Charge0
Average Mass659.002
Monoisotopic Mass658.53837
SMILESCCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCCCCC)C(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C38H74O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-32(39)31(28-26-24-22-20-18-16-14-12-10-8-6-4-2)37(43)45-30-33-34(40)35(41)36(42)38(44)46-33/h31-36,38-42,44H,3-30H2,1-2H3/t31?,32?,33-,34-,35+,36-,38?/m1/s1
InChIKeyAQVWXIRCPXPVPT-UNCJEZMPSA-N
Roles Classification
Biological Role:
antigen  Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).
ChEBI Ontology
Outgoing Relation(s)
6-deoxy-D-glucos-6-yl corynomycolate (CHEBI:74256) has functional parent D-glucopyranose (CHEBI:4167)
6-deoxy-D-glucos-6-yl corynomycolate (CHEBI:74256) has functional parent corynomycolic acid (CHEBI:60916)
6-deoxy-D-glucos-6-yl corynomycolate (CHEBI:74256) has role antigen (CHEBI:59132)
6-deoxy-D-glucos-6-yl corynomycolate (CHEBI:74256) is a mycolate ester (CHEBI:74253)
Incoming Relation(s)
6-deoxy-D-glucos-6-yl (2R,3R)-corynomycolate (CHEBI:77816) is a 6-deoxy-D-glucos-6-yl corynomycolate (CHEBI:74256)
IUPAC Name 
6-O-(3-hydroxy-2-tetradecyloctadecanoyl)-D-glucopyranose
Synonyms  Source
glucose 6-O-monomycolateChEBI
C32 glucose MMChEBI
glucose monomycolate (C32)ChEBI
glucose MM (C32)ChEBI
C32 GMMChEBI
C32-GMMChEBI
Citations