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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-STR029672
GlyTouCan
G95351SA
version 2
Glycan Information
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Composition
HexA 2
Mass Value Search
GlcA 2
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
IMNADAQGVSDVMI-WOQIFIIUSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
2
H
1
8
O
1
3
/
c
1
3
-
1
-
2
(
1
4
)
7
(
1
0
(
2
0
)
2
1
)
2
4
-
1
2
(
5
(
1
)
1
7
)
2
5
-
8
-
4
(
1
6
)
3
(
1
5
)
6
(
9
(
1
8
)
1
9
)
2
3
-
1
1
(
8
)
2
2
/
h
1
-
8
,
1
1
-
1
7
,
2
2
H
,
(
H
,
1
8
,
1
9
)
(
H
,
2
0
,
2
1
)
/
t
1
-
,
2
-
,
3
-
,
4
-
,
5
+
,
6
-
,
7
-
,
8
+
,
1
1
-
,
1
2
-
/
m
0
/
s
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SMILES
O[C@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C(O)=O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
370.0747
370.267
Permethylated
Oligosaccharides
482.1999
482.4822
Peracetylated
Oligosaccharides
622.1381
622.4907
External Links
GlycomeDB
(Structure)
GlycomeDB
8450
8450
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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