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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-STR000936
GlyTouCan
G23447MZ
version 2
Glycan Information
6
GalNAc b-dgal-HEX-1:5
GlcNAc b-dglc-HEX-1:5
Glyco Tree
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Composition
HexNAc 2
Mass Value Search
GalNAc 1 GlcNAc 1
Structural Isomer Search
Descriptors Computed from Structure
InChIKey
ZNYQSCCJIAFAQX-PUUZRBPYSA-N
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InChI
I
n
C
h
I
=
1
S
/
C
1
6
H
2
8
N
2
O
1
1
/
c
1
-
5
(
2
0
)
1
7
-
9
-
1
3
(
2
4
)
1
2
(
2
3
)
8
(
2
8
-
1
5
(
9
)
2
6
)
4
-
2
7
-
1
6
-
1
0
(
1
8
-
6
(
2
)
2
1
)
1
4
(
2
5
)
1
1
(
2
2
)
7
(
3
-
1
9
)
2
9
-
1
6
/
h
7
-
1
6
,
1
9
,
2
2
-
2
6
H
,
3
-
4
H
2
,
1
-
2
H
3
,
(
H
,
1
7
,
2
0
)
(
H
,
1
8
,
2
1
)
/
t
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
CC(=O)N[C@H]1[C@H](O)O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@@H]1O
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Mass
Monoisotopic Mass
Average Mass
Underivatised
Oligosaccharides
424.1693
424.4052
Permethylated
Oligosaccharides
536.2945
536.6202
Peracetylated
Oligosaccharides
676.2327
676.6288
External Links
GlycomeDB
(Structure)
GlycomeDB
10843
10843
©2008-2009 Research Center for Medical Glycoscience, National Institute of Advanced Industrial Science and Technology (AIST)
CompositionDescriptors Computed from StructureMass
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