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

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ChEBI Name 6-deoxy-D-glucos-6-yl corynomycolate
ChEBI ID CHEBI:74256
ChEBI ASCII Name 6-deoxy-D-glucos-6-yl corynomycolate
Definition A 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.)
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000031168439
Download Molfile XML SDF
Formula C38H74O8
Net Charge 0
Average Mass 658.98940
Monoisotopic Mass 658.53837
InChI InChI=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
InChIKey AQVWXIRCPXPVPT-UNCJEZMPSA-N
SMILES CCCCCCCCCCCCCCCC(O)C(CCCCCCCCCCCCCC)C(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O
Roles Classification
Biological Role(s): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 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 Sources
C32 glucose MM ChEBI
C32 GMM ChEBI
C32-GMM ChEBI
glucose 6-O-monomycolate ChEBI
glucose MM (C32) ChEBI
glucose monomycolate (C32) ChEBI
Citations
Last Modified
09 August 2018