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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-STR016573
GlyTouCan
G52232PE
version 2
Glycan Information
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Composition
Pen 3
Mass Value Search
Ara 3
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
LGVIJIIZVBKMRC-SXGBGLMXSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
5
H
2
6
O
1
3
/
c
1
6
-
1
-
4
-
7
(
1
8
)
1
0
(
2
1
)
1
5
(
2
6
-
4
)
2
8
-
1
2
-
5
(
2
-
1
7
)
2
7
-
1
4
(
1
1
(
1
2
)
2
2
)
2
4
-
3
-
6
-
8
(
1
9
)
9
(
2
0
)
1
3
(
2
3
)
2
5
-
6
/
h
4
-
2
3
H
,
1
-
3
H
2
/
t
4
-
,
5
-
,
6
-
,
7
-
,
8
-
,
9
+
,
1
0
+
,
1
1
+
,
1
2
-
,
1
3
+
,
1
4
+
,
1
5
-
/
m
1
/
s
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SMILES
OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](OC[C@H]3O[C@H](O)[C@@H](O)[C@@H]3O)O[C@@H]2CO)[C@@H](O)[C@@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
414.1374
414.3635
Permethylated
Oligosaccharides
526.2627
526.5787
Peracetylated
Oligosaccharides
750.2219
750.6618
External Links
GlycomeDB
(Structure)
GlycomeDB
25420
25420
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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