Chem
J-GLOBAL ID:200907018089983980   Nikkaji number:J1.900.469D

1-O-[(S)-1-[N-(9H-Fluoren-9-ylmethoxycarbonyl)-L-phenylalanylmethyl]-2-oxo-2-methoxyethyl]-β-D-glucopyranose 2,3,4,6-tetraacetate

1-O-[(S)-1-[N-(9H-フルオレン-9-イルメトキシカルボニル)-L-フェニルアラニルメチル]-2-オキソ-2-メトキシエチル]-β-D-グルコピラノース2,3,4,6-テトラアセタート
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: C42H45NO15
Molecular formula furigana: C42-H45-N-O15
Molecular weight: 803.814
InChI: InChI=1S/C42H45NO15/c1-23(44)52-22-36-37(54-24(2)45)38(55-25(3)46)39(56-26(4)47)41(58-36)57-35(40(49)51-5)20-34(48)33(19-27-13-7-6-8-14-27)43-42(50)53-21-32-30-17-11-9-15-28(30)29-16-10-12-18-31(29)32/h6-18,32-33,35-39,41H,19-22H2,1-5H3,(H,43,50)/t33-,35-,36+,37+,38-,39+,41+/m0/s1
InChI key: DBKJHVKMNRQPRN-NYLJIDHPSA-N
SMILES: COC(=O)[C@H](CC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2c2ccccc12)O[C@@H]1O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name  (3):
  • 1-O-[(S)-1-[N-(9H-フルオレン-9-イルメトキシカルボニル)-L-フェニルアラニルメチル]-2-オキソ-2-メトキシエチル]-β-D-グルコピラノース2,3,4,6-テトラアセタート
  • メチル (2S,5S)-5-({[(9H-フルオレン-9-イル)メトキシ]カルボニル}アミノ)-4-オキソ-6-フェニル-2-{[(2S,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-[(アセチルオキシ)メチル]オキサン-2-イル]オキシ}ヘキサノアート
  • methyl (2S,5S)-5-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-oxo-6-phenyl-2-{[(2S,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}hexanoate
Other name (1):
  • 1-O-[(S)-1-[N-(9H-Fluoren-9-ylmethoxycarbonyl)-L-phenylalanylmethyl]-2-oxo-2-methoxyethyl]-β-D-glucopyranose 2,3,4,6-tetraacetate
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