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ChEBI
> Main
CHEBI:62290 - ethyl
N
-acetylneuraminate
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ChEBI Name
ethyl
N
-acetylneuraminate
ChEBI ID
CHEBI:62290
ChEBI ASCII Name
ethyl N-acetylneuraminate
Definition
The carboxylic ester that is the ethyl ester of
N
-acetylneuraminic acid.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H23NO9
Net Charge
0
Average Mass
337.32300
Monoisotopic Mass
337.13728
InChI
InChI=1S/C13H23NO9/c1-
3-
22-
12(20)
13(21)
4-
7(17)
9(14-
6(2)
16)
11(23-
13)
10(19)
8(18)
5-
15/h7-
11,15,17-
19,21H,3-
5H2,1-
2H3,(H,14,16)
/t7-
,8+,9+,10+,11+,13?/m0/s1
InChIKey
BUPUCDUZUNSEOP-CHNADMEASA-N
SMILES
[H][C@]1(OC(O)(C[C@H](O)[C@H]1NC(C)=O)C(=O)OCC)[C@H](O)[C@H](O)CO
ChEBI Ontology
Outgoing
ethyl
N
-acetylneuraminate (
CHEBI:62290
)
has functional parent
N
-acetylneuraminic acid (
CHEBI:17012
)
ethyl
N
-acetylneuraminate (
CHEBI:62290
)
is a
acetamides (
CHEBI:22160
)
ethyl
N
-acetylneuraminate (
CHEBI:62290
)
is a
ethyl ester (
CHEBI:23990
)
IUPAC Name
ethyl 5-
acetamido-
3,5-
dideoxy-
D
-
glycero
-
D
-
galacto
-
non-
2-
ulopyranosonate
Registry Number
Type
Source
15845638
Reaxys Registry Number
Reaxys
Citations
Types
Sources
18068975
PubMed citation
Europe PMC
18487279
PubMed citation
Europe PMC
Last Modified
02 March 2015