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CHEBI:173083 - aceneuramate
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ChEBI Name
aceneuramate
ChEBI ID
CHEBI:173083
Definition
An
N
-acetylneuraminate that is the conjugate base of aceneuramic acid arising from the deprotonation of the carboxy group. Major microspecies at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Molfile
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Molfile
Formula
C11H18NO9
Net Charge
-1
Average Mass
308.264
Monoisotopic Mass
308.09870
InChI
InChI=1S/C11H19NO9/c1-
4(14)
12-
8(5(15)
2-
6(16)
11(20)
21)
10(19)
9(18)
7(17)
3-
13/h5,7-
10,13,15,17-
19H,2-
3H2,1H3,(H,12,14)
(H,20,21)
/p-
1/t5-
,7+,8+,9+,10+/m0/s1
InChIKey
KBGAYAKRZNYFFG-BOHATCBPSA-M
SMILES
CC(=O)N[C@H]([C@@H](O)CC(=O)C([O-])=O)[C@@H](O)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing
aceneuramate (
CHEBI:173083
)
is a
2-oxo monocarboxylic acid anion (
CHEBI:35179
)
aceneuramate (
CHEBI:173083
)
is a
N
-acetylneuraminates (
CHEBI:21619
)
aceneuramate (
CHEBI:173083
)
is conjugate base of
aceneuramic acid (
CHEBI:173082
)
Incoming
aceneuramic acid (
CHEBI:173082
)
is conjugate acid of
aceneuramate (
CHEBI:173083
)
IUPAC Name
5-
acetamido-
3,5-
dideoxy-
D
-
glycero
-
D
-
galacto
-
non-
2-
ulosonate
Synonyms
Sources
(4
S
,5
R
,6
R
,7
S
,8
R
)-
5-
acetamido-
4,6,7,8,9-
pentahydroxy-
2-
oxononanoate
IUPAC
aceneuramate
UniProt
N
-acetyl-keto-neuraminate
MetaCyc
N
-acetylneuraminate
ChEBI
Neu5Ac(1−)
ChEBI
Manual Xref
Database
CPD0-2701
MetaCyc
View more database links
Citations
Types
Sources
30422107
PubMed citation
Europe PMC
33895133
PubMed citation
Europe PMC
Last Modified
28 May 2021