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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-STR031580
GlyTouCan
G93723GS
version 2
Glycan Information
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Composition
HexA 1
Mass Value Search
GlcA 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
AEMOLEFTQBMNLQ-QIUUJYRFSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
6
H
1
0
O
7
/
c
7
-
1
-
2
(
8
)
4
(
5
(
1
0
)
1
1
)
1
3
-
6
(
1
2
)
3
(
1
)
9
/
h
1
-
4
,
6
-
9
,
1
2
H
,
(
H
,
1
0
,
1
1
)
/
t
1
-
,
2
-
,
3
+
,
4
-
,
6
+
/
m
0
/
s
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SMILES
O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
194.0426
194.1411
Permethylated
Oligosaccharides
264.1209
264.2756
Peracetylated
Oligosaccharides
362.0849
362.2903
External Links
GMDB
(MS
n
)
GMDB
OSO-000242
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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