322000-85-1 ((Cyclo[L-isoleucyl-(2R)-2-piperidinecarbonyl-N6-(2-methoxy-2-oxoethyl)-L-lysyl-1-methoxy-L-tryptophyl])

CAS号:
322000-85-1
英文名称:
Cyclo[L-isoleucyl-(2R)-2-piperidinecarbonyl-N6-(2-methoxy-2-oxoethyl)-L-lysyl-1-methoxy-L-tryptophyl]
分子式:
C33H48N6O7
分子量:
640.770228385925

Cyclo[L-isoleucyl-(2R)-2-piperidinecarbonyl-N6-(2-methoxy-2-oxoethyl)-L-lysyl-1-methoxy-L-tryptophyl](322000-85-1)名称与标识符

名称

英文别名:
Cyclo[L-isoleucyl-(2R)-2-piperidinecarbonyl-N6-(2-methoxy-2-oxoethyl)- L-lysyl-1-methoxy-L-tryptophyl];Cyclo[L-isoleucyl-(2R)-2-piperidinecarbonyl-N6-(2-methoxy-2-oxoethyl)-L-lysyl-1-methoxy-L-tryptophyl] (9CI);

标识符

InChIKey:
LYJGCIDKGWYVOJ-RCIPKSMKSA-N
Inchi:
1S/C33H48N6O7/c1-5-21(2)29-33(44)38-17-11-9-15-27(38)32(43)35-24(13-8-10-16-34-19-28(40)45-3)30(41)36-25(31(42)37-29)18-22-20-39(46-4)26-14-7-6-12-23(22)26/h6-7,12,14,20-21,24-25,27,29,34H,5,8-11,13,15-19H2,1-4H3,(H,35,43)(H,36,41)(H,37,42)/t21-,24-,25-,27+,29-/m0/s1
SMILES:
C([C@@H]1NC([C@@H](NC([C@@]2([H])CCCCN2C([C@@]([H])(NC1=O)[C@@H](C)CC)=O)=O)CCCCNCC(=O)OC)=O)C1=CN(C2=CC=CC=C12)OC

Cyclo[L-isoleucyl-(2R)-2-piperidinecarbonyl-N6-(2-methoxy-2-oxoethyl)-L-lysyl-1-methoxy-L-tryptophyl](322000-85-1)物化性质

实验特性

  • 酸度系数(pKa) : 13.08±0.70(Predicted)
  • 密度 : 1.32±0.1 g/cm3(Predicted)