Chem
J-GLOBAL ID：201707008035736674   Nikkaji number：J3.606.940F

(R)-N-[α-(Diphenoxyphosphinyl)phenethyl]-2-[N-[1,4-dioxo-4-(succinimidyloxy)butyl]-L-alanylthio]propanamide

(R)-N-[α-(ジフェノキシホスフィニル)フェネチル]-2-[N-[1,4-ジオキソ-4-(スクシンイミジルオキシ)ブチル]-L-アラニルチオ]プロパンアミド
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： C34H36N3O10PS
Molecular formula furigana： C34-H36-N3-O10-P-S
Molecular weight： 709.710
InChI： InChI=1S/C34H36N3O10PS/c1-23(35-28(38)18-21-32(41)45-37-30(39)19-20-31(37)40)34(43)49-24(2)33(42)36-29(22-25-12-6-3-7-13-25)48(44,46-26-14-8-4-9-15-26)47-27-16-10-5-11-17-27/h3-17,23-24,29H,18-22H2,1-2H3,(H,35,38)(H,36,42)/t23-,24+,29?/m0/s1
InChI key： BLUUBYNDXVVQHJ-FEMHNBHWSA-N
SMILES： C[C@H](NC(=O)CCC(=O)ON1C(=O)CCC1=O)C(=O)S[C@H](C)C(=O)NC(Cc1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1
Systematic name  (3)：
  • (R)-N-[α-(ジフェノキシホスフィニル)フェネチル]-2-[N-[1,4-ジオキソ-4-(スクシンイミジルオキシ)ブチル]-L-アラニルチオ]プロパンアミド
  • 2,5-ジオキソピロリジン-1-イル 3-{[(2S)-1-{[(1R)-1-{[1-(ジフェノキシホスホリル)-2-フェニルエチル]カルバモイル}エチル]スルファニル}-1-オキソプロパン-2-イル]カルバモイル}プロパノアート
  • 2,5-dioxopyrrolidin-1-yl 3-{[(2S)-1-{[(1R)-1-{[1-(diphenoxyphosphoryl)-2-phenylethyl]carbamoyl}ethyl]sulfanyl}-1-oxopropan-2-yl]carbamoyl}propanoate
Other name (1)：
  • (R)-N-[α-(Diphenoxyphosphinyl)phenethyl]-2-[N-[1,4-dioxo-4-(succinimidyloxy)butyl]-L-alanylthio]propanamide
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