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構造リスト
JCGGDB Glycan Structure
Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
JCGGDB ID
JCGG-STR028385
GlyTouCan
G89416UR
version 2
Glycan Information
Glyco Tree
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Composition
Hex 1 Neu5Ac 1
Mass Value Search
Glc 1 Neu5Ac 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
ZWJUGLBUMFWRAR-XEYZHEBMSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
7
H
2
9
N
O
1
4
/
c
1
-
5
(
2
0
)
1
8
-
9
-
6
(
2
1
)
2
-
1
7
(
1
6
(
2
8
)
2
9
,
3
2
-
1
4
(
9
)
1
0
(
2
3
)
7
(
2
2
)
3
-
1
9
)
3
0
-
4
-
8
-
1
1
(
2
4
)
1
2
(
2
5
)
1
3
(
2
6
)
1
5
(
2
7
)
3
1
-
8
/
h
6
-
1
5
,
1
9
,
2
1
-
2
7
H
,
2
-
4
H
2
,
1
H
3
,
(
H
,
1
8
,
2
0
)
(
H
,
2
8
,
2
9
)
/
t
6
-
,
7
+
,
8
+
,
9
+
,
1
0
+
,
1
1
+
,
1
2
-
,
1
3
+
,
1
4
+
,
1
5
-
,
1
7
+
/
m
0
/
s
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SMILES
CC(=O)N[C@@H]1[C@@H](O)C[C@@](OC[C@H]2O[C@H](O)[C@H](O)[C@@H](O)[C@@H]2O)(O[C@H]1[C@H](O)[C@H](O)CO)C(O)=O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
471.1587
471.4155
Permethylated
Oligosaccharides
611.3154
611.6842
Peracetylated
Oligosaccharides
807.2433
807.7138
External Links
GlycomeDB
(Structure)
GlycomeDB
7267
7267
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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