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ChEBI
> Main
CHEBI:147850 - α-Neu
p
5Ac-(2→6)-
D
-Glc
p
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ChEBI Name
α-Neu
p
5Ac-(2→6)-
D
-Glc
p
ChEBI ID
CHEBI:147850
ChEBI ASCII Name
alpha-Neup5Ac-(2->6)-D-Glcp
Definition
An amino disaccharide consisting of
N
-acetylneuraminic acid and
D
-glucopyranose residues joined in sequence by a (1→6) glycosidic bond.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Gareth Owen
Supplier Information
Download
Molfile
XML
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Molfile
Formula
C19H32N2O14
Net Charge
0
Average Mass
512.465
Monoisotopic Mass
512.18535
InChI
InChI=1S/C19H32N2O14/c1-
6(23)
20-
11-
8(25)
3-
19(18(31)
32,35-
16(11)
13(27)
9(26)
4-
22)
33-
5-
10-
14(28)
15(29)
12(17(30)
34-
10)
21-
7(2)
24/h8-
17,22,25-
30H,3-
5H2,1-
2H3,(H,20,23)
(H,21,24)
(H,31,32)
/t8-
,9+,10+,11+,12+,13+,14+,15+,16+,17?,19+/m0/s1
InChIKey
CZOGCRVBCLRHQJ-ZKLMBDLJSA-N
SMILES
O1[C@H]
([C@H]
(NC(=O)
C)
[C@@H]
(O)
C[C@]
1(OC[C@H]
2OC(O)
[C@H]
(NC(=O)
C)
[C@@H]
(O)
[C@@H]
2O)
C(O)
=O)
[C@H]
(O)
[C@H]
(O)
CO
ChEBI Ontology
Outgoing
α-Neu
p
5Ac-(2→6)-
D
-Glc
p
(
CHEBI:147850
)
is a
acetamides (
CHEBI:22160
)
α-Neu
p
5Ac-(2→6)-
D
-Glc
p
(
CHEBI:147850
)
is a
amino disaccharide (
CHEBI:22480
)
α-Neu
p
5Ac-(2→6)-
D
-Glc
p
(
CHEBI:147850
)
is a
neuraminic acids (
CHEBI:25508
)
IUPAC Names
2-
acetamido-
6-
O
-
(5-
acetamido-
3,5-
dideoxy-
D
-
glycero
-
α-
D
-
galacto
-
non-
2-
ulopyranonosyl)-
2-
deoxy-
D
-
glucopyranose
NeuAc(a2-6)GlcNAc
Synonyms
Sources
(2
R
,4
S
,5
R
,6
R
)-
5-
Acetamido-
2-
[[(2
R
,3
S
,4
R
,5
R
)-
5-
acetamido-
3,4,6-
trihydroxyoxan-
2-
yl]methoxy]-
4-
hydroxy-
6-
[(1
R
,2
R
)-
1,2,3-
trihydroxypropyl]oxane-
2-
carboxylic acid
IUPAC
5-
acetamido-
3,5-
dideoxy-
D
-
glycero
-
α-
D
-
galacto
-
non-
2-
ulopyranosylonic acid-
(2→6)-
2-
acetamido-
2-
deoxy-
D
-
gluco
-
hexopyranose
IUPAC
WURCS=2.0/2,2,1/[a2122h-1x_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O]/1-2/a6-b2
SUBMITTER
Manual Xref
Database
G18185ZH
GlyTouCan
View more database links
Last Modified
26 May 2020