化学式

CAS号

IUPAC Name

3-N-[(3S,5S)-1-[(2S)-2-[[(2S)-2-[氯(甲基)氨基]丙酰基]氨基]-3,3-dimethylbutanoyl]-5-[[(1R)-1-苯基乙基]氨基甲酰]吡咯烷-3-基]-1-N-[(3S,5S)-1-[(2S)-3,3-二甲基-2-[[(2S)-2-(甲基氨基)丙酰基]氨基]butanoyl]-5-[[(1R)-1-苯基乙基]氨基甲酰]吡咯烷-3-基]-5-甲氧基苯-1,3-二甲酰胺 3-N-[(3S,5S)-1-[(2S)-2-[[(2S)-2-[chloro(methyl)amino]propanoyl]amino]-3,3-dimethylbutanoyl]-5-[[(1R)-1-phenylethyl]carbamoyl]pyrrolidin-3-yl]-1-N-[(3S,5S)-1-[(2S)-3,3-dimethyl-2-[[(2S)-2-(methylamino)propanoyl]amino]butanoyl]-5-[[(1R)-1-phenylethyl]carbamoyl]pyrrolidin-3-yl]-5-methoxybenzene-1,3-dicarboxamide

InChI

InChI=1S/C55H77ClN10O9/c1-31(35-20-16-14-17-21-35)58-50(71)42-27-39(29-65(42)52(73)44(54(5,6)7)62-46(67)33(3)57-11)60-48(69)37-24-38(26-41(25-37)75-13)49(70)61-40-28-43(51(72)59-32(2)36-22-18-15-19-23-36)66(30-40)53(74)45(55(8,9)10)63-47(68)34(4)64(12)56/h14-26,31-34,39-40,42-45,57H,27-30H2,1-13H3,(H,58,71)(H,59,72)(H,60,69)(H,61,70)(H,62,67)(H,63,68)/t31-,32-,33+,34+,39+,40+,42+,43+,44-,45-/m1/s1

InChI Key

YKHSMLDCQLJFTG-YHSPLLFTSA-N

Canonical SMILES

CC(C1=CC=CC=C1)NC(=O)C2CC(CN2C(=O)C(C(C)(C)C)NC(=O)C(C)NC)NC(=O)C3=CC(=CC(=C3)OC)C(=O)NC4CC(N(C4)C(=O)C(C(C)(C)C)NC(=O)C(C)N(C)Cl)C(=O)NC(C)C5=CC=CC=C5

别名

• SCHEMBL16138396