Chem
J-GLOBAL ID:200907099316935709   Nikkaji number:J1.432.900E

1-(Phenylthio)-2-O-acetyl-3-O-[2-O-(4-methoxybenzoyl)-3-O,4-O-bis(triethylsilyl)-β-D-xylopyranosyl]-4-O-(triethylsilyl)-1-deoxy-α-L-arabinopyranose

1-(フェニルチオ)-2-O-アセチル-3-O-[2-O-(4-メトキシベンゾイル)-3-O,4-O-ビス(トリエチルシリル)-β-D-キシロピラノシル]-4-O-(トリエチルシリル)-1-デオキシ-α-L-アラビノピラノース
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: C44H72O11SSi3
Molecular formula furigana: C44-H72-O11-S-SI3
Molecular weight: 893.360
InChI: InChI=1S/C44H72O11SSi3/c1-12-57(13-2,14-3)53-36-31-49-44(56-35-24-22-21-23-25-35)41(50-32(10)45)38(36)52-43-40(51-42(46)33-26-28-34(47-11)29-27-33)39(55-59(18-7,19-8)20-9)37(30-48-43)54-58(15-4,16-5)17-6/h21-29,36-41,43-44H,12-20,30-31H2,1-11H3/t36-,37+,38-,39-,40+,41+,43-,44-/m0/s1
InChI key: HEGITWKQVSYVHA-UTQZQQENSA-N
SMILES: CC[Si](CC)(CC)O[C@H]1CO[C@@H](Sc2ccccc2)[C@H](OC(=O)C)[C@H]1O[C@@H]1OC[C@@H](O[Si](CC)(CC)CC)[C@H](O[Si](CC)(CC)CC)[C@H]1OC(=O)c1ccc(OC)cc1
Systematic name  (3):
  • 1-(フェニルチオ)-2-O-アセチル-3-O-[2-O-(4-メトキシベンゾイル)-3-O,4-O-ビス(トリエチルシリル)-β-D-キシロピラノシル]-4-O-(トリエチルシリル)-1-デオキシ-α-L-アラビノピラノース
  • (2S,3R,4R,5R)-2-{[(2S,3R,4R,5S)-3-(アセチルオキシ)-2-(フェニルスルファニル)-5-[(トリエチルシリル)オキシ]オキサン-4-イル]オキシ}-4,5-ビス[(トリエチルシリル)オキシ]オキサン-3-イル 4-メトキシベンゾアート
  • (2S,3R,4R,5R)-2-{[(2S,3R,4R,5S)-3-(acetyloxy)-2-(phenylsulfanyl)-5-[(triethylsilyl)oxy]oxan-4-yl]oxy}-4,5-bis[(triethylsilyl)oxy]oxan-3-yl 4-methoxybenzoate
Other name (1):
  • 1-(Phenylthio)-2-O-acetyl-3-O-[2-O-(4-methoxybenzoyl)-3-O,4-O-bis(triethylsilyl)-β-D-xylopyranosyl]-4-O-(triethylsilyl)-1-deoxy-α-L-arabinopyranose
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