Chem
J-GLOBAL ID:200907051649287116   Nikkaji number:J1.504.371G

α,α-Dimethyl-3β-[(S)-α-[(9H-fluorene-9-ylmethoxycarbonyl)amino]phenethyl]oxirane-2α-thioacetic acid S-tert-butyl ester

α,α-ジメチル-3β-[(S)-α-[(9H-フルオレン-9-イルメトキシカルボニル)アミノ]フェネチル]オキシラン-2α-チオ酢酸S-tert-ブチル
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: C33H37NO4S
Molecular formula furigana: C33-H37-N-O4-S
Molecular weight: 543.720
InChI: InChI=1S/C33H37NO4S/c1-32(2,3)39-30(35)33(4,5)29-28(38-29)27(19-21-13-7-6-8-14-21)34-31(36)37-20-26-24-17-11-9-15-22(24)23-16-10-12-18-25(23)26/h6-18,26-29H,19-20H2,1-5H3,(H,34,36)/t27-,28+,29-/m0/s1
InChI key: GGCFKCPRMUSMAH-NHKHRBQYSA-N
SMILES: CC(C)(C)SC(=O)C(C)(C)[C@H]1O[C@@H]1[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2c2ccccc12
Systematic name  (3):
  • α,α-ジメチル-3β-[(S)-α-[(9H-フルオレン-9-イルメトキシカルボニル)アミノ]フェネチル]オキシラン-2α-チオ酢酸S-tert-ブチル
  • (9H-フルオレン-9-イル)メチル N-[(1S)-1-[(2R,3R)-3-[1-(tert-ブチルスルファニル)-2-メチル-1-オキソプロパン-2-イル]オキシラン-2-イル]-2-フェニルエチル]カルバマート
  • (9H-fluoren-9-yl)methyl N-[(1S)-1-[(2R,3R)-3-[1-(tert-butylsulfanyl)-2-methyl-1-oxopropan-2-yl]oxiran-2-yl]-2-phenylethyl]carbamate
Other name (1):
  • α,α-Dimethyl-3β-[(S)-α-[(9H-fluorene-9-ylmethoxycarbonyl)amino]phenethyl]oxirane-2α-thioacetic acid S-tert-butyl ester
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