Chem
J-GLOBAL ID：201707005261089976   Nikkaji number：J3.606.937F

N-[(4-Pentynoylthio)acetyl]-D-Ala-D-Ala-[α-(diphenoxyphosphinyl)phenethyl]NH2

N-[(4-ペンチノイルチオ)アセチル]-D-Ala-D-Ala-[α-(ジフェノキシホスフィニル)フェネチル]NH2
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： C33H36N3O7PS
Molecular formula furigana： C33-H36-N3-O7-P-S
Molecular weight： 649.700
InChI： InChI=1S/C33H36N3O7PS/c1-4-5-21-31(38)45-23-29(37)34-24(2)32(39)35-25(3)33(40)36-30(22-26-15-9-6-10-16-26)44(41,42-27-17-11-7-12-18-27)43-28-19-13-8-14-20-28/h1,6-20,24-25,30H,5,21-23H2,2-3H3,(H,34,37)(H,35,39)(H,36,40)/t24-,25-,30?/m1/s1
InChI key： GSCIGPCHTXHBSD-KUZPKSQGSA-N
SMILES： C[C@@H](NC(=O)CSC(=O)CCC#C)C(=O)N[C@H](C)C(=O)NC(Cc1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1
Systematic name  (3)：
  • N-[(4-ペンチノイルチオ)アセチル]-D-Ala-D-Ala-[α-(ジフェノキシホスフィニル)フェネチル]NH2
  • ジフェニル {1-[(2R)-2-[(2R)-2-[2-(ペンタ-4-イノイルスルファニル)アセトアミド]プロパンアミド]プロパンアミド]-2-フェニルエチル}ホスホナート
  • diphenyl {1-[(2R)-2-[(2R)-2-[2-(pent-4-ynoylsulfanyl)acetamido]propanamido]propanamido]-2-phenylethyl}phosphonate
Other name (1)：
  • N-[(4-Pentynoylthio)acetyl]-D-Ala-D-Ala-[α-(diphenoxyphosphinyl)phenethyl]NH2
Thsaurus map：
Thesaurus Map

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