Registration Dossier

General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
2,3,4,6-tetrakis-O-(2,2-dimethylpropanoyl)--D-glucopyranosyl bromide
Synonyms
Names:
(2R,3R,4S,5R,6R)-2-bromo-6-((pivaloyloxy)methyl)tetrahydro-2Hpyran-3,4,5-triyl tris(2,2-dimethylpropanoate)
2,3,4,6-Tetra-O-pivaloyl-α-D-glucopyranosyl bromide
JNJ-42808389-AAA
T003421
Tetra-O-pivaloyl-α-D-glucopyranosyl bromide
Identifier:
CAS number
81058-27-7
Identifier:
EC number
686-241-8
Identifier:
IUPAC name
(2S,3R,4S,5R,6R)-2-bromo-6-((pivaloyloxy)methyl)tetrahydro-2H-pyran-3,4,5-triyl tris(2,2-dimethylpropanoate)
Identifier:
IUPAC name
2,3,4,6-tetrakis-O-(2,2-dimethylpropanoyl)-α-D-glucopyranosyl bromide
Identifier:
other: SMILES notation
Br[C@H]1O[C@H](COC(C(C)(C)C)=O)[C@@H](OC(C(C)(C)C)=O)[C@H](OC(C(C)(C)C)=O)[C@H]1OC(C(C)(C)C)=O
Identifier:
other: InChl
InChI=1S/C26H43BrO9/c1-23(2,3)19(28)32-13-14-15(34-20(29)24(4,5)6)16(35-21(30)25(7,8)9)17(18(27)33-14)36-22(31)26(10,11)12/h14-18H,13H2,1-12H3/t14-,15-,16+,17-,18+/m1/s1
[(2R,3R,4S,5R,6R)-6-bromo-3,4,5-tris(2,2-dimethylpropanoyloxy)oxan-2-yl]methyl 2,2-dimethylpropanoate

CAS information

CAS number:
81058-27-7

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Identifiers of related substancesopen allclose all
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Molecular and structural information

Molecular formula:
C26H43BrO9
Molecular weight:
ca. 579.53
SMILES notation:
CC(C)(C)C(=O)OCC1C(C(C(C(O1)Br)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C
InChl:
InChI=1S/C26H43BrO9/c1-23(2,3)19(28)32-13-14-15(34-20(29)24(4,5)6)16(35-21(30)25(7,8)9)17(18(27)33-14)36-22(31)26(10,11)12/h14-18H,13H2,1-12H3/t14-,15-,16+,17-,18+/m1/s1
Structural formula:
Chemical structure