SpectraBase Spectrum ID |
LJQVFH1Kyb2 |
Name |
DL-epi-Inositol, 1,2-anhydro-6-bromo-3,4,6-trideoxy-4-[(phenylsulfonyl)amino]- |
CAS Registry Number |
87160-78-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H14BrNO4S |
InChI |
InChI=1S/C12H14BrNO4S/c13-10-11(15)8(6-9-12(10)18-9)14-19(16,17)7-4-2-1-3-5-7/h1-5,8-12,14-15H,6H2/t8-,9+,10+,11+,12-/m0/s1 |
InChIKey |
RVVCDRZKSODEFG-KQSJRHEJSA-N |
Molecular Weight |
348.211 g/mol |
SMILES |
O[C@@]1([C@](C[C@]2(O[C@@]2([C@@]1(Br)[H])[H])[H])(NS(=O)(=O)c1ccccc1)[H])[H] |
SPLASH |
splash10-004i-9320000000-1665cf14022318ebc700 |
Source of Spectrum |
K-116-2512-0 |
Synonyms |
7-Oxabicyclo[4.1.0]heptane, DL-epi-inositol deriv.
DL-(1.alpha.,2.alpha.,3.beta.,4.beta.,6.alpha.)-2-bromo-4-[(phenylsulfonyl)amino]-7-oxabicyclo[4.1.0]heptan-3-ol
N-[(1R,3S,4R,5R,6S)-5-bromo-4-hydroxy-7-oxabicyclo[4.1.0]hept-3-yl]benzenesulfonamide |
Wiley ID |
1339842 |