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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-STR028406
GlyTouCan
G16720XZ
version 2
Glycan Information
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Composition
HexNAc 1 Pen 1 dHex 1
Mass Value Search
Fuc 1 GlcNAc 1 Xyl 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
OXVVIHSNHKEZFM-KCFPIJLOSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
9
H
3
3
N
O
1
4
/
c
1
-
5
-
1
0
(
2
3
)
1
4
(
2
7
)
1
6
(
3
4
-
1
8
-
1
5
(
2
8
)
1
1
(
2
4
)
7
(
2
2
)
3
-
3
0
-
1
8
)
1
9
(
3
2
-
5
)
3
1
-
4
-
8
-
1
2
(
2
5
)
1
3
(
2
6
)
9
(
1
7
(
2
9
)
3
3
-
8
)
2
0
-
6
(
2
)
2
1
/
h
5
,
7
-
1
9
,
2
2
-
2
9
H
,
3
-
4
H
2
,
1
-
2
H
3
,
(
H
,
2
0
,
2
1
)
/
t
5
-
,
7
-
,
8
-
,
9
-
,
1
0
+
,
1
1
+
,
1
2
-
,
1
3
-
,
1
4
+
,
1
5
-
,
1
6
-
,
1
7
-
,
1
8
+
,
1
9
-
/
m
1
/
s
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SMILES
C[C@H]1O[C@@H](OC[C@H]2O[C@@H](O)[C@H](NC(C)=O)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
499.1901
499.4693
Permethylated
Oligosaccharides
625.3309
625.7112
Peracetylated
Oligosaccharides
835.2746
835.7676
External Links
GlycomeDB
(Structure)
GlycomeDB
7287
7287
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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