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ChEBI
> Main
CHEBI:64882 - (
S
)-malyl
N
-acetyl-α-
D
-glucosaminide
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ChEBI Name
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide
ChEBI ID
CHEBI:64882
ChEBI ASCII Name
(S)-malyl N-acetyl-alpha-D-glucosaminide
Definition
An
N
-acetyl-α-
D
-glucosaminide having (
S
)-malyl as the anomeric substituent.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C12H19NO10
Net Charge
0
Average Mass
337.28000
Monoisotopic Mass
337.10090
InChI
InChI=1S/C12H19NO10/c1-
4(15)
13-
8-
10(19)
9(18)
6(3-
14)
23-
12(8)
22-
5(11(20)
21)
2-
7(16)
17/h5-
6,8-
10,12,14,18-
19H,2-
3H2,1H3,(H,13,15)
(H,16,17)
(H,20,21)
/t5-
,6+,8+,9+,10+,12-
/m0/s1
InChIKey
COBMRTSHZAUOCY-BVKYVCSXSA-N
SMILES
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@H]1O[C@@H](CC(O)=O)C(O)=O
Roles Classification
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
(via
N-acetyl-D-glucosaminide
)
(via
D-glucosaminide
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide (
CHEBI:64882
)
has functional parent
(
S
)-malic acid (
CHEBI:30797
)
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide (
CHEBI:64882
)
is a
N
-acetyl-α-
D
-glucosaminide (
CHEBI:27425
)
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide (
CHEBI:64882
)
is conjugate acid of
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide(2−) (
CHEBI:64870
)
Incoming
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide(2−) (
CHEBI:64870
)
is conjugate base of
(
S
)-malyl
N
-acetyl-α-
D
-glucosaminide (
CHEBI:64882
)
IUPAC Name
(2
S
)-2-[(2-acetamido-2-deoxy-α-
D
-glucopyranosyl)oxy]butanedioic acid
Synonyms
Sources
(2
S
)-2-[(2-acetamido-2-deoxy-α-
D
-glucopyranosyl)oxy]succinic acid
IUPAC
α-
D
-GlcNAc-
L
-Mal
ChEBI
GlcNAc-Mal
MetaCyc
malyl-N-acetyl-D-glucosamine
MetaCyc
Manual Xref
Database
CPD8J2-1
MetaCyc
View more database links
Last Modified
20 June 2012