Chem
J-GLOBAL ID：200907002043517255   Nikkaji number：J1.952.620H

3α-(2-Bromobenzyloxy)-4β,6β-diaminocyclohexane-1α,2β-diol

3α-(2-ブロモベンジルオキシ)-4β,6β-ジアミノシクロヘキサン-1α,2β-ジオール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C13H19BrN2O3
Molecular formula furigana： C13-H19-BR-N2-O3
Molecular weight： 331.210
InChI： InChI=1S/C13H19BrN2O3/c14-8-4-2-1-3-7(8)6-19-13-10(16)5-9(15)11(17)12(13)18/h1-4,9-13,17-18H,5-6,15-16H2/t9-,10+,11+,12-,13-/m1/s1
InChI key： QERAMAVVJCNIEZ-KSSYENDESA-N
SMILES： N[C@@H]1C[C@H](N)[C@@H](OCc2ccccc2Br)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 3α-(2-ブロモベンジルオキシ)-4β,6β-ジアミノシクロヘキサン-1α,2β-ジオール
  • (1S,2R,3R,4S,6R)-4,6-ジアミノ-3-[(2-ブロモフェニル)メトキシ]シクロヘキサン-1,2-ジオール
  • (1S,2R,3R,4S,6R)-4,6-diamino-3-[(2-bromophenyl)methoxy]cyclohexane-1,2-diol
Other name (1)：
  • 3α-(2-Bromobenzyloxy)-4β,6β-diaminocyclohexane-1α,2β-diol
Thsaurus map：
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