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> Main
CHEBI:74251 - glycerol mono(keto-meromycolate)
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ChEBI Name
glycerol mono(keto-meromycolate)
ChEBI ID
CHEBI:74251
Definition
A mycolate ester formed by esterification of keto-meromycolic acid with the 1-OH of glycerol.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C84H164O6
Net Charge
0
Average Mass
1270.19740
Monoisotopic Mass
1269.25279
InChI
InChI=1S/C84H164O6/c1-
4-
6-
8-
10-
12-
14-
16-
18-
20-
22-
23-
24-
26-
30-
34-
41-
47-
53-
59-
65-
71-
81(84(89)
90-
76-
80(86)
75-
85)
83(88)
73-
67-
61-
55-
49-
43-
37-
36-
40-
46-
52-
58-
64-
70-
79-
74-
78(79)
69-
63-
57-
51-
45-
39-
33-
29-
27-
31-
35-
42-
48-
54-
60-
66-
72-
82(87)
77(3)
68-
62-
56-
50-
44-
38-
32-
28-
25-
21-
19-
17-
15-
13-
11-
9-
7-
5-
2/h77-
81,83,85-
86,88H,4-
76H2,1-
3H3
InChIKey
CAFCXJLNGZTNND-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCCCCCCCCC(C(O)
CCCCCCCCCCCCCCC1CC1CCCCCCCCCCCCCCCCCC(=O)
C(C)
CCCCCCCCCCCCCCCCCCC)
C(=O)
OCC(O)
CO
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
glycerol mono(keto-meromycolate) (
CHEBI:74251
)
has functional parent
glycerol (
CHEBI:17754
)
glycerol mono(keto-meromycolate) (
CHEBI:74251
)
has functional parent
keto-meromycolic acid (
CHEBI:74248
)
glycerol mono(keto-meromycolate) (
CHEBI:74251
)
has role
antigen (
CHEBI:59132
)
glycerol mono(keto-meromycolate) (
CHEBI:74251
)
is a
mycolate ester (
CHEBI:74253
)
IUPAC Name
2,3-
dihydroxypropyl 2-
{1-
hydroxy-
15-
[2-
(19-
methyl-
18-
oxooctatriacontyl)cyclopropyl]pentadecyl}tetracosanoate
Citation
Type
Source
23727893
PubMed citation
Europe PMC
Last Modified
21 June 2013