Chem
J-GLOBAL ID：200907003054057767   Nikkaji number：J2.150.007K

3-Bromo-4-methyl-7-[(2-azido-4-O-benzyl-3-O,6-O-diacetyl-2-deoxy-D-glucopyranosyl)oxy]-2H-1-benzopyran-2-one

3-ブロモ-4-メチル-7-[(2-アジド-4-O-ベンジル-3-O,6-O-ジアセチル-2-デオキシ-D-グルコピラノシル)オキシ]-2H-1-ベンゾピラン-2-オン
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： C27H26BrN[N-][N+]O9
Molecular formula furigana： C27-H26-BR-N3-O9
Molecular weight： 616.421
InChI： InChI=1S/C27H26BrN3O9/c1-14-19-10-9-18(11-20(19)39-26(34)22(14)28)38-27-23(30-31-29)25(37-16(3)33)24(21(40-27)13-35-15(2)32)36-12-17-7-5-4-6-8-17/h4-11,21,23-25,27H,12-13H2,1-3H3/t21-,23-,24-,25-,27?/m1/s1
InChI key： NCNRQZSGRFVIDC-LPIJIDLKSA-N
SMILES： CC(=O)OC[C@H]1OC(Oc2ccc3c(C)c(Br)c(=O)oc3c2)[C@H](N=[N+]=[N-])[C@@H](OC(=O)C)[C@@H]1OCc1ccccc1
Systematic name  (3)：
  • 3-ブロモ-4-メチル-7-[(2-アジド-4-O-ベンジル-3-O,6-O-ジアセチル-2-デオキシ-D-グルコピラノシル)オキシ]-2H-1-ベンゾピラン-2-オン
  • [(2R,3S,4R,5R)-4-(アセチルオキシ)-5-アジド-3-(ベンジルオキシ)-6-[(3-ブロモ-4-メチル-2-オキソ-2H-クロメン-7-イル)オキシ]オキサン-2-イル]メチル アセタート
  • [(2R,3S,4R,5R)-4-(acetyloxy)-5-azido-3-(benzyloxy)-6-[(3-bromo-4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxan-2-yl]methyl acetate
Other name (1)：
  • 3-Bromo-4-methyl-7-[(2-azido-4-O-benzyl-3-O,6-O-diacetyl-2-deoxy-D-glucopyranosyl)oxy]-2H-1-benzopyran-2-one
Thsaurus map：
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