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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-STR002581
GlyTouCan
G33525OF
version 2
Glycan Information
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Composition
Pen 2 dHex 2
Mass Value Search
Rha 2 Xyl 2
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
ZZQGAXOGXBACGQ-IRYNDQLRSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
2
2
H
3
8
O
1
7
/
c
1
-
5
-
9
(
2
5
)
1
2
(
2
8
)
1
3
(
2
9
)
2
1
(
3
5
-
5
)
3
7
-
1
6
-
8
(
2
4
)
4
-
3
4
-
2
0
(
1
4
(
1
6
)
3
0
)
3
8
-
1
7
-
1
0
(
2
6
)
6
(
2
)
3
6
-
2
2
(
1
5
(
1
7
)
3
1
)
3
9
-
1
8
-
1
1
(
2
7
)
7
(
2
3
)
3
-
3
3
-
1
9
(
1
8
)
3
2
/
h
5
-
3
2
H
,
3
-
4
H
2
,
1
-
2
H
3
/
t
5
-
,
6
-
,
7
+
,
8
+
,
9
-
,
1
0
-
,
1
1
-
,
1
2
+
,
1
3
+
,
1
4
+
,
1
5
+
,
1
6
-
,
1
7
+
,
1
8
+
,
1
9
+
,
2
0
-
,
2
1
-
,
2
2
-
/
m
0
/
s
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SMILES
C[C@@H]1O[C@@H](O[C@H]2[C@H](O)CO[C@@H](O[C@@H]3[C@@H](O)[C@H](C)O[C@@H](O[C@H]4[C@H](O)OC[C@@H](O)[C@@H]4O)[C@@H]3O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
574.2109
574.5334
Permethylated
Oligosaccharides
714.3675
714.8024
Peracetylated
Oligosaccharides
994.3165
994.9064
External Links
GlycomeDB
(Structure)
GlycomeDB
12367
12367
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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