Chem
J-GLOBAL ID:200907025245802059   Nikkaji number:J2.615.618A

(2R,3S)-1,3-Bis(tert-butyldimethylsiloxy)-2-(benzyloxycarbonylamino)-4-(4-methylphenylthio)-6-octadecene

(2R,3S)-1,3-ビス(tert-ブチルジメチルシロキシ)-2-(ベンジルオキシカルボニルアミノ)-4-(4-メチルフェニルチオ)-6-オクタデセン
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: C45H77NO4SSi2
Molecular formula furigana: C45-H77-N-O4-S-SI2
Molecular weight: 784.340
InChI: InChI=1S/C45H77NO4SSi2/c1-13-14-15-16-17-18-19-20-21-22-23-27-30-41(51-39-33-31-37(2)32-34-39)42(50-53(11,12)45(6,7)8)40(36-49-52(9,10)44(3,4)5)46-43(47)48-35-38-28-25-24-26-29-38/h23-29,31-34,40-42H,13-22,30,35-36H2,1-12H3,(H,46,47)/t40-,41?,42+/m1/s1
InChI key: WLAAHCDUTODYGA-PTBOWACNSA-N
SMILES: CCCCCCCCCCCC=CCC(Sc1ccc(C)cc1)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OCc1ccccc1
Systematic name  (3):
  • (2R,3S)-1,3-ビス(tert-ブチルジメチルシロキシ)-2-(ベンジルオキシカルボニルアミノ)-4-(4-メチルフェニルチオ)-6-オクタデセン
  • ベンジル N-[(5S,6R)-2,2,3,3,9,9,10,10-オクタメチル-5-{1-[(4-メチルフェニル)スルファニル]ペンタデカ-3-エン-1-イル}-4,8-ジオキサ-3,9-ジシラウンデカン-6-イル]カルバマート
  • benzyl N-[(5S,6R)-2,2,3,3,9,9,10,10-octamethyl-5-{1-[(4-methylphenyl)sulfanyl]pentadec-3-en-1-yl}-4,8-dioxa-3,9-disilaundecan-6-yl]carbamate
Other name (1):
  • (2R,3S)-1,3-Bis(tert-butyldimethylsiloxy)-2-(benzyloxycarbonylamino)-4-(4-methylphenylthio)-6-octadecene
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