Chem
J-GLOBAL ID:200907049993601674   Nikkaji number:J1.823.617F

(3S,4R,5R)-3-(Benzoylamino)-3-(tert-butyldiphenylsilyloxymethyl)-4-(benzoyloxy)-5-[(1S,2E)-1-[1-(trimethylsilyl)ethoxymethoxy]-9-(2-hexyl-1,3-dioxolane-2-yl)-2-nonenyl]tetrahydrofuran-2-one

(3S,4R,5R)-3-(ベンゾイルアミノ)-3-(tert-ブチルジフェニルシリルオキシメチル)-4-(ベンゾイルオキシ)-5-[(1S,2E)-1-[1-(トリメチルシリル)エトキシメトキシ]-9-(2-ヘキシル-1,3-ジオキソラン-2-イル)-2-ノネニル]テトラヒドロフラン-2-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: C59H81NO10Si2
Molecular formula furigana: C59-H81-N-O10-SI2
Molecular weight: 1020.464
InChI: InChI=1S/C59H81NO10Si2/c1-9-10-11-29-40-58(66-42-43-67-58)41-30-15-13-12-14-28-39-51(65-45-64-46(2)71(6,7)8)52-53(70-55(62)48-33-22-17-23-34-48)59(56(63)69-52,60-54(61)47-31-20-16-21-32-47)44-68-72(57(3,4)5,49-35-24-18-25-36-49)50-37-26-19-27-38-50/h16-28,31-39,46,51-53H,9-15,29-30,40-45H2,1-8H3,(H,60,61)/b39-28+/t46?,51-,52+,53-,59-/m0/s1
InChI key: ZFQLHHASAIVGBF-SLKZSXMGSA-N
SMILES: CCCCCCC1(CCCCCC/C=C/[C@H](OCOC(C)[Si](C)(C)C)[C@H]2OC(=O)[C@@](CO[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)(NC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)OCCO1
Systematic name  (3):
  • (3S,4R,5R)-3-(ベンゾイルアミノ)-3-(tert-ブチルジフェニルシリルオキシメチル)-4-(ベンゾイルオキシ)-5-[(1S,2E)-1-[1-(トリメチルシリル)エトキシメトキシ]-9-(2-ヘキシル-1,3-ジオキソラン-2-イル)-2-ノネニル]テトラヒドロフラン-2-オン
  • (2R,3R,4S)-4-ベンズアミド-4-{[(tert-ブチルジフェニルシリル)オキシ]メチル}-2-[(1S,2E)-9-(2-ヘキシル-1,3-ジオキソラン-2-イル)-1-{[1-(トリメチルシリル)エトキシ]メトキシ}ノナ-2-エン-1-イル]-5-オキソオキソラン-3-イル ベンゾアート
  • (2R,3R,4S)-4-benzamido-4-{[(tert-butyldiphenylsilyl)oxy]methyl}-2-[(1S,2E)-9-(2-hexyl-1,3-dioxolan-2-yl)-1-{[1-(trimethylsilyl)ethoxy]methoxy}non-2-en-1-yl]-5-oxooxolan-3-yl benzoate
Other name (1):
  • (3S,4R,5R)-3-(Benzoylamino)-3-(tert-butyldiphenylsilyloxymethyl)-4-(benzoyloxy)-5-[(1S,2E)-1-[1-(trimethylsilyl)ethoxymethoxy]-9-(2-hexyl-1,3-dioxolane-2-yl)-2-nonenyl]tetrahydrofuran-2-one
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