Chem
J-GLOBAL ID:200907049325995245   Nikkaji number:J2.225.446D

(3R,4S,6R,10R,12S,13S,14S)-3,4-(Isopropylidenebisoxy)-6,10,14-trimethyl-7-(phenylsulfonyl)-8-hydroxy-12,13-bis(tert-butyldimethylsiloxy)-15-(tert-butyldiphenylsiloxy)pentadecane-2-one trimethylene dithioacetal

(3R,4S,6R,10R,12S,13S,14S)-3,4-(イソプロピリデンビスオキシ)-6,10,14-トリメチル-7-(フェニルスルホニル)-8-ヒドロキシ-12,13-ビス(tert-ブチルジメチルシロキシ)-15-(tert-ブチルジフェニルシロキシ)ペンタデカン-2-オントリメチレンジチオアセタール
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: C58H96O8S3Si3
Molecular formula furigana: C58-H96-O8-S3-SI3
Molecular weight: 1101.830
InChI: InChI=1S/C58H96O8S3Si3/c1-42(38-48(59)52(69(60,61)45-30-23-20-24-31-45)43(2)40-50-53(64-57(13,14)63-50)58(15)67-36-29-37-68-58)39-49(65-70(16,17)54(4,5)6)51(66-71(18,19)55(7,8)9)44(3)41-62-72(56(10,11)12,46-32-25-21-26-33-46)47-34-27-22-28-35-47/h20-28,30-35,42-44,48-53,59H,29,36-41H2,1-19H3/t42-,43-,44+,48?,49+,50+,51+,52?,53-/m1/s1
InChI key: JBSDXKWFWZPZOX-BGXPEEJBSA-N
SMILES: C[C@H](CC(O)C([C@H](C)C[C@@H]1OC(C)(C)O[C@H]1C1(C)SCCCS1)S(=O)(=O)c1ccccc1)C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
Systematic name  (3):
  • (3R,4S,6R,10R,12S,13S,14S)-3,4-(イソプロピリデンビスオキシ)-6,10,14-トリメチル-7-(フェニルスルホニル)-8-ヒドロキシ-12,13-ビス(tert-ブチルジメチルシロキシ)-15-(tert-ブチルジフェニルシロキシ)ペンタデカン-2-オントリメチレンジチオアセタール
  • (2R,6R,8S,9S,10S)-3-(ベンゼンスルホニル)-8,9-ビス[(tert-ブチルジメチルシリル)オキシ]-11-[(tert-ブチルジフェニルシリル)オキシ]-1-[(4S,5R)-2,2-ジメチル-5-(2-メチル-1,3-ジチアン-2-イル)-1,3-ジオキソラン-4-イル]-2,6,10-トリメチルウンデカン-4-オール
  • (2R,6R,8S,9S,10S)-3-(benzenesulfonyl)-8,9-bis[(tert-butyldimethylsilyl)oxy]-11-[(tert-butyldiphenylsilyl)oxy]-1-[(4S,5R)-2,2-dimethyl-5-(2-methyl-1,3-dithian-2-yl)-1,3-dioxolan-4-yl]-2,6,10-trimethylundecan-4-ol
Other name (1):
  • (3R,4S,6R,10R,12S,13S,14S)-3,4-(Isopropylidenebisoxy)-6,10,14-trimethyl-7-(phenylsulfonyl)-8-hydroxy-12,13-bis(tert-butyldimethylsiloxy)-15-(tert-butyldiphenylsiloxy)pentadecane-2-one trimethylene dithioacetal
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