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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-STR032501
GlyTouCan
G83391QQ
version 2
Glycan Information
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Composition
Hex 3 HexNAc 5 Neu5Ac 2
Mass Value Search
Gal 3 GalNAc 2 GlcNAc 3 Neu5Ac 2
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
XOUXJRCXQZKXIR-XEFRJZHGSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
8
0
H
1
3
1
N
7
O
5
7
/
c
1
-
2
0
(
9
5
)
8
1
-
3
9
-
2
7
(
1
0
2
)
8
-
7
9
(
7
7
(
1
2
2
)
1
2
3
,
1
4
3
-
6
5
(
3
9
)
4
6
(
1
0
6
)
2
9
(
1
0
4
)
1
0
-
8
8
)
1
2
7
-
1
8
-
3
7
-
4
9
(
1
0
9
)
5
7
(
1
1
7
)
5
8
(
1
1
8
)
7
4
(
1
3
6
-
3
7
)
1
3
7
-
6
1
-
3
4
(
1
5
-
9
3
)
1
3
3
-
7
0
(
4
2
(
5
5
(
6
1
)
1
1
5
)
8
4
-
2
3
(
4
)
9
8
)
1
2
6
-
1
7
-
3
6
-
5
3
(
1
1
3
)
6
8
(
1
4
2
-
7
3
-
4
5
(
8
7
-
2
6
(
7
)
1
0
1
)
6
4
(
5
0
(
1
1
0
)
3
2
(
1
3
-
9
1
)
1
3
1
CompositionDescriptors Computed from Structure
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