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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:45823 - 2-(β-
D
-glucosyl)benzothiazole
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ChEBI Ontology
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ChEBI Name
2-(β-
D
-glucosyl)benzothiazole
ChEBI ID
CHEBI:45823
ChEBI ASCII Name
2-(beta-D-glucosyl)benzothiazole
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C13H15NO5S
Net Charge
0
Average Mass
297.32794
Monoisotopic Mass
297.06709
InChI
InChI=1S/C13H15NO5S/c15-
5-
7-
9(16)
10(17)
11(18)
12(19-
7)
13-
14-
6-
3-
1-
2-
4-
8(6)
20-
13/h1-
4,7,9-
12,15-
18H,5H2/t7-
,9-
,10+,11-
,12-
/m1/s1
InChIKey
VXYWGTFRKRQDQI-DVYMNCLGSA-N
SMILES
OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1nc2ccccc2s1
ChEBI Ontology
Outgoing
2-(β-
D
-glucosyl)benzothiazole (
CHEBI:45823
)
is a
C
-glycosyl compound (
CHEBI:20857
)
2-(β-
D
-glucosyl)benzothiazole (
CHEBI:45823
)
is a
benzothiazoles (
CHEBI:37947
)
IUPAC Name
(1
R
)-1,5-anhydro-1-(1,3-benzothiazol-2-yl)-
D
-glucitol
Last Modified
16 May 2008