Chem
J-GLOBAL ID:200907051623020502   Nikkaji number:J1.331.365B

(1R)-N-(4-Fluorophenylsulfonyl)-2β-[3-hydroxy-4-(2-fluorophenylthio)butyl]-3α,5α-dihydroxycyclopentane-1α-heptanamide

(1R)-N-(4-フルオロフェニルスルホニル)-2β-[3-ヒドロキシ-4-(2-フルオロフェニルチオ)ブチル]-3α,5α-ジヒドロキシシクロペンタン-1α-ヘプタンアミド
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: C28H37F2NO6S2
Molecular formula furigana: C28-H37-F2-N-O6-S2
Molecular weight: 585.720
InChI: InChI=1S/C28H37F2NO6S2/c29-19-11-14-21(15-12-19)39(36,37)31-28(35)10-4-2-1-3-7-22-23(26(34)17-25(22)33)16-13-20(32)18-38-27-9-6-5-8-24(27)30/h5-6,8-9,11-12,14-15,20,22-23,25-26,32-34H,1-4,7,10,13,16-18H2,(H,31,35)/t20?,22-,23-,25+,26-/m1/s1
InChI key: UBHUZXHLFKYJPE-YDJLLXMBSA-N
SMILES: OC(CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)NS(=O)(=O)c1ccc(F)cc1)CSc1ccccc1F
Systematic name  (3):
  • (1R)-N-(4-フルオロフェニルスルホニル)-2β-[3-ヒドロキシ-4-(2-フルオロフェニルチオ)ブチル]-3α,5α-ジヒドロキシシクロペンタン-1α-ヘプタンアミド
  • N-(4-フルオロベンゼンスルホニル)-7-[(1R,2R,3R,5S)-2-{4-[(2-フルオロフェニル)スルファニル]-3-ヒドロキシブチル}-3,5-ジヒドロキシシクロペンチル]ヘプタンアミド
  • N-(4-fluorobenzenesulfonyl)-7-[(1R,2R,3R,5S)-2-{4-[(2-fluorophenyl)sulfanyl]-3-hydroxybutyl}-3,5-dihydroxycyclopentyl]heptanamide
Other name (1):
  • (1R)-N-(4-Fluorophenylsulfonyl)-2β-[3-hydroxy-4-(2-fluorophenylthio)butyl]-3α,5α-dihydroxycyclopentane-1α-heptanamide
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