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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-STR002543
GlyTouCan
G50037OE
version 2
Glycan Information
Glyco Tree
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Composition
Pen 3 dHex 1
Mass Value Search
Rha 1 Xyl 3
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
WPFLWOUHXMABCS-MNKLUNHQSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
2
1
H
3
6
O
1
7
/
c
1
-
5
-
1
5
(
1
1
(
2
7
)
1
3
(
2
9
)
2
1
(
3
5
-
5
)
3
8
-
1
7
-
1
0
(
2
6
)
7
(
2
3
)
2
-
3
2
-
1
8
(
1
7
)
3
1
)
3
6
-
2
0
-
1
4
(
3
0
)
1
6
(
8
(
2
4
)
4
-
3
4
-
2
0
)
3
7
-
1
9
-
1
2
(
2
8
)
9
(
2
5
)
6
(
2
2
)
3
-
3
3
-
1
9
/
h
5
-
3
1
H
,
2
-
4
H
2
,
1
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
-
/
m
0
/
s
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SMILES
C[C@@H]1O[C@@H](O[C@H]2[C@H](O)OC[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
560.1953
560.5065
Permethylated
Oligosaccharides
700.3518
700.7755
Peracetylated
Oligosaccharides
980.3009
980.8795
External Links
GlycomeDB
(Structure)
GlycomeDB
12332
12332
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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