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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-STR017544
GlyTouCan
G78202UH
version 2
Glycan Information
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Composition
Hex 1 HexA 1
Mass Value Search
Glc 1 GlcA 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
ITKVPEKYGFDVPF-YKASPPPDSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
2
H
2
2
O
1
2
/
c
1
3
-
1
-
3
(
1
4
)
5
(
1
6
)
6
(
1
7
)
4
(
1
5
)
2
-
2
3
-
1
2
-
9
(
2
0
)
7
(
1
8
)
8
(
1
9
)
1
0
(
2
4
-
1
2
)
1
1
(
2
1
)
2
2
/
h
3
-
1
0
,
1
2
-
2
0
H
,
1
-
2
H
2
,
(
H
,
2
1
,
2
2
)
/
t
3
-
,
4
+
,
5
+
,
6
+
,
7
-
,
8
-
,
9
+
,
1
0
-
,
1
2
+
/
m
0
/
s
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SMILES
OC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[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
374.106
374.2987
Permethylated
Oligosaccharides
514.2626
514.5676
Peracetylated
Oligosaccharides
752.2011
752.6342
External Links
GlycomeDB
(Structure)
GlycomeDB
26312
26312
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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