Chem
J-GLOBAL ID:200907049247468497   Nikkaji number:J2.172.872A

(5R)-1-(2-Tosylethyl)-3-(3,4-dimethoxybenzyl)-5β-(tert-butyldiphenylsiloxymethyl)-7-tosyl-8α-(triisopropylsiloxymethyl)-8bα-hydroxy-1,2,3,5,5aα,6,7,8,8aα,8b-decahydropyrrolo[3,4-e]benzimidazole-2,6-dione

(5R)-1-(2-トシルエチル)-3-(3,4-ジメトキシベンジル)-5β-(tert-ブチルジフェニルシロキシメチル)-7-トシル-8α-(トリイソプロピルシロキシメチル)-8bα-ヒドロキシ-1,2,3,5,5aα,6,7,8,8aα,8b-デカヒドロピロロ[3,4-e]ベンゾイミダゾール-2,6-ジオン
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: C61H79N3O11S2Si2
Molecular formula furigana: C61-H79-N3-O11-S2-SI2
Molecular weight: 1150.600
InChI: InChI=1S/C61H79N3O11S2Si2/c1-41(2)78(42(3)4,43(5)6)74-40-52-57-56(58(65)64(52)77(70,71)49-31-26-45(8)27-32-49)47(39-75-79(60(9,10)11,50-20-16-14-17-21-50)51-22-18-15-19-23-51)37-55-61(57,67)63(34-35-76(68,69)48-29-24-44(7)25-30-48)59(66)62(55)38-46-28-33-53(72-12)54(36-46)73-13/h14-33,36-37,41-43,47,52,56-57,67H,34-35,38-40H2,1-13H3/t47-,52+,56+,57+,61+/m0/s1
InChI key: ISQZYTGXFRIFGK-LFDCGVESSA-N
SMILES: COc1ccc(CN2C(=O)N(CCS(=O)(=O)c3ccc(C)cc3)[C@]3(O)[C@@H]4[C@@H](CO[Si](C(C)C)(C(C)C)C(C)C)N(C(=O)[C@@H]4[C@H](CO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)C=C23)S(=O)(=O)c2ccc(C)cc2)cc1OC
Systematic name  (3):
  • (5R)-1-(2-トシルエチル)-3-(3,4-ジメトキシベンジル)-5β-(tert-ブチルジフェニルシロキシメチル)-7-トシル-8α-(トリイソプロピルシロキシメチル)-8bα-ヒドロキシ-1,2,3,5,5aα,6,7,8,8aα,8b-デカヒドロピロロ[3,4-e]ベンゾイミダゾール-2,6-ジオン
  • (5R,5aR,8S,8aS,8bS)-5-{[(tert-ブチルジフェニルシリル)オキシ]メチル}-3-[(3,4-ジメトキシフェニル)メチル]-8b-ヒドロキシ-7-(4-メチルベンゼンスルホニル)-1-[2-(4-メチルベンゼンスルホニル)エチル]-8-({[トリス(プロパン-2-イル)シリル]オキシ}メチル)-1H,2H,3H,5H,5aH,6H,7H,8H,8aH,8bH-イミダゾ[4,5-e]イソインドール-2,6-ジオン
  • (5R,5aR,8S,8aS,8bS)-5-{[(tert-butyldiphenylsilyl)oxy]methyl}-3-[(3,4-dimethoxyphenyl)methyl]-8b-hydroxy-7-(4-methylbenzenesulfonyl)-1-[2-(4-methylbenzenesulfonyl)ethyl]-8-({[tris(propan-2-yl)silyl]oxy}methyl)-1H,2H,3H,5H,5aH,6H,7H,8H,8aH,8bH-imidazo[4,5-e]isoindole-2,6-dione
Other name (1):
  • (5R)-1-(2-Tosylethyl)-3-(3,4-dimethoxybenzyl)-5β-(tert-butyldiphenylsiloxymethyl)-7-tosyl-8α-(triisopropylsiloxymethyl)-8bα-hydroxy-1,2,3,5,5aα,6,7,8,8aα,8b-decahydropyrrolo[3,4-e]benzimidazole-2,6-dione
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