Chem
J-GLOBAL ID:200907051781160524   Nikkaji number:J1.390.637H

Methyl 3-O,4-O,6-O-triacetyl-2-[[(S)-3-[(benzyloxycarbonyl)amino]-4-(benzyloxy)-4-oxobutyryl]amino]-2-deoxy-β-D-glucopyranoside

メチル3-O,4-O,6-O-トリアセチル-2-[[(S)-3-[(ベンジルオキシカルボニル)アミノ]-4-(ベンジルオキシ)-4-オキソブチリル]アミノ]-2-デオキシ-β-D-グルコピラノシド
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: C32H38N2O13
Molecular formula furigana: C32-H38-N2-O13
Molecular weight: 658.657
InChI: InChI=1S/C32H38N2O13/c1-19(35)42-18-25-28(45-20(2)36)29(46-21(3)37)27(31(41-4)47-25)34-26(38)15-24(30(39)43-16-22-11-7-5-8-12-22)33-32(40)44-17-23-13-9-6-10-14-23/h5-14,24-25,27-29,31H,15-18H2,1-4H3,(H,33,40)(H,34,38)/t24-,25+,27+,28+,29+,31+/m0/s1
InChI key: DEGJXQKJUBQIQI-YVJYRJHXSA-N
SMILES: CO[C@@H]1O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1
Systematic name  (3):
  • メチル3-O,4-O,6-O-トリアセチル-2-[[(S)-3-[(ベンジルオキシカルボニル)アミノ]-4-(ベンジルオキシ)-4-オキソブチリル]アミノ]-2-デオキシ-β-D-グルコピラノシド
  • ベンジル (2S)-2-{[(ベンジルオキシ)カルボニル]アミノ}-3-{[(2R,3R,4R,5S,6R)-4,5-ビス(アセチルオキシ)-6-[(アセチルオキシ)メチル]-2-メトキシオキサン-3-イル]カルバモイル}プロパノアート
  • benzyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-{[(2R,3R,4R,5S,6R)-4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-2-methoxyoxan-3-yl]carbamoyl}propanoate
Other name (1):
  • Methyl 3-O,4-O,6-O-triacetyl-2-[[(S)-3-[(benzyloxycarbonyl)amino]-4-(benzyloxy)-4-oxobutyryl]amino]-2-deoxy-β-D-glucopyranoside
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