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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-STR002188
GlyTouCan
G58254CZ
version 2
Glycan Information
Glyco Tree
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Composition
Hex 1 Pen 2
Mass Value Search
Glc 1 Xyl 2
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
LWLLQWCVXUZOHA-DUXBMZBYSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
6
H
2
8
O
1
4
/
c
1
7
-
1
-
6
-
1
2
(
2
9
-
1
5
-
9
(
2
2
)
7
(
2
0
)
4
(
1
8
)
2
-
2
6
-
1
5
)
1
1
(
2
4
)
1
3
(
1
4
(
2
5
)
2
8
-
6
)
3
0
-
1
6
-
1
0
(
2
3
)
8
(
2
1
)
5
(
1
9
)
3
-
2
7
-
1
6
/
h
4
-
2
5
H
,
1
-
3
H
2
/
t
4
-
,
5
-
,
6
-
,
7
+
,
8
+
,
9
-
,
1
0
-
,
1
1
+
,
1
2
-
,
1
3
-
,
1
4
-
,
1
5
+
,
1
6
+
/
m
1
/
s
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SMILES
OC[C@H]1O[C@@H](O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
444.1479
444.3898
Permethylated
Oligosaccharides
570.2889
570.6318
Peracetylated
Oligosaccharides
822.2429
822.7254
External Links
GlycomeDB
(Structure)
GlycomeDB
12004
12004
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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