Chem
J-GLOBAL ID:200907036043112303   Nikkaji number:J1.308.190E

3-O-(2-O,3-O,4-O-Triacetyl-6-O-benzyl-β-D-galactopyranosyl)-4-O,6-O-benzylidene-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl azide

3-O-(2-O,3-O,4-O-トリアセチル-6-O-ベンジル-β-D-ガラクトピラノシル)-4-O,6-O-ベンジリデン-2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノシルアザイド
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: C34H40N2[N-][N+]O13
Molecular formula furigana: C34-H40-N4-O13
Molecular weight: 712.709
InChI: InChI=1S/C34H40N4O13/c1-18(39)36-26-29(27-25(48-32(26)37-38-35)17-44-33(50-27)23-13-9-6-10-14-23)51-34-31(47-21(4)42)30(46-20(3)41)28(45-19(2)40)24(49-34)16-43-15-22-11-7-5-8-12-22/h5-14,24-34H,15-17H2,1-4H3,(H,36,39)/t24-,25-,26-,27-,28+,29-,30+,31-,32-,33?,34+/m1/s1
InChI key: OIIBLGYWEISHNX-BAIFWSCKSA-N
SMILES: CC(=O)N[C@H]1[C@@H](O[C@@H]2COC(O[C@H]2[C@@H]1O[C@@H]1O[C@H](COCc2ccccc2)[C@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1OC(=O)C)c1ccccc1)N=[N+]=[N-]
Systematic name  (3):
  • 3-O-(2-O,3-O,4-O-トリアセチル-6-O-ベンジル-β-D-ガラクトピラノシル)-4-O,6-O-ベンジリデン-2-(アセチルアミノ)-2-デオキシ-β-D-グルコピラノシルアザイド
  • (2R,3S,4S,5R,6R)-6-{[(4aR,6R,7R,8R,8aS)-6-アジド-7-アセトアミド-2-フェニル-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-8-イル]オキシ}-4,5-ビス(アセチルオキシ)-2-[(ベンジルオキシ)メチル]オキサン-3-イル アセタート
  • (2R,3S,4S,5R,6R)-6-{[(4aR,6R,7R,8R,8aS)-6-azido-7-acetamido-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-8-yl]oxy}-4,5-bis(acetyloxy)-2-[(benzyloxy)methyl]oxan-3-yl acetate
Other name (1):
  • 3-O-(2-O,3-O,4-O-Triacetyl-6-O-benzyl-β-D-galactopyranosyl)-4-O,6-O-benzylidene-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl azide
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