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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-STR017334
GlyTouCan
G14023WK
version 2
Glycan Information
Glyco Tree
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Composition
Hex 1 HexNAc 1
Mass Value Search
Gal 1 GlcNAc 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
PJAADWAJCPITFH-BTQUHPNKSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
4
H
2
7
N
O
1
1
/
c
1
-
5
(
1
9
)
1
5
-
9
-
1
2
(
2
4
)
1
1
(
2
3
)
8
(
4
-
1
8
)
2
5
-
1
4
(
9
)
2
6
-
1
3
(
7
(
2
1
)
3
-
1
7
)
1
0
(
2
2
)
6
(
2
0
)
2
-
1
6
/
h
6
-
1
4
,
1
6
-
1
8
,
2
0
-
2
4
H
,
2
-
4
H
2
,
1
H
3
,
(
H
,
1
5
,
1
9
)
/
t
6
-
,
7
+
,
8
-
,
9
-
,
1
0
+
,
1
1
-
,
1
2
-
,
1
3
-
,
1
4
+
/
m
1
/
s
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SMILES
CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O[C@H]([C@@H](O)CO)[C@@H](O)[C@H](O)CO
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
401.1533
401.3678
Permethylated
Oligosaccharides
541.3099
541.6366
Peracetylated
Oligosaccharides
779.2483
779.7032
External Links
GlycomeDB
(Structure)
GlycomeDB
2612
2612
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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