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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-STR004829
GlyTouCan
G59658KK
version 2
Glycan Information
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Composition
Hex 4 HexNAc 4 Neu5Ac 1 dHex 3
Mass Value Search
Fuc 3 Gal 4 GalNAc 1 GlcNAc 3 Neu5Ac 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
HLUVHKTYYHZDFD-VORZIKFWSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
8
5
H
1
4
1
N
5
O
6
1
/
c
1
-
1
9
-
4
2
(
1
0
5
)
5
2
(
1
1
5
)
5
7
(
1
2
0
)
7
7
(
1
3
1
-
1
9
)
1
4
3
-
6
5
-
3
4
(
1
6
-
9
7
)
1
4
0
-
7
6
(
4
1
(
9
0
-
2
6
(
8
)
1
0
2
)
6
9
(
6
5
)
1
4
7
-
8
3
-
7
2
(
5
6
(
1
1
9
)
4
7
(
1
1
0
)
3
0
(
1
2
-
9
3
)
1
3
7
-
8
3
)
1
4
9
-
7
9
-
5
9
(
1
2
2
)
5
4
(
1
1
7
)
4
4
(
1
0
7
)
2
1
(
3
)
1
3
3
-
7
9
)
1
4
8
-
7
0
-
5
0
(
1
1
3
)
3
6
(
1
8
-
1
2
9
-
7
4
-
3
8
(
8
7
-
2
3
(
5
)
9
9
)
5
1
(
1
1
4
)
6
3
(
3
2
(
1
4
-
9
5
CompositionDescriptors Computed from Structure
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