100642-82-8 ((Butanamide, glycyl-L-histidyl-L-phenylalanyl-4-(methylsulfinyl)-L-2-amino- (9CI))

CAS号:
100642-82-8
英文名称:
Butanamide, glycyl-L-histidyl-L-phenylalanyl-4-(methylsulfinyl)-L-2-amino- (9CI)
分子式:
C22H31N7O5S
分子量:
505.590442895889

Butanamide, glycyl-L-histidyl-L-phenylalanyl-4-(methylsulfinyl)-L-2-amino- (9CI)(100642-82-8)名称与标识符

名称

英文别名:
Butanamide, glycyl-L-histidyl-L-phenylalanyl-4-(methylsulfinyl)-L-2-amino- (9CI);

标识符

InChIKey:
DJXISFCALHFSMJ-NBZBWBJPSA-N
Inchi:
1S/C22H31N7O5S/c1-35(34)8-7-16(24)20(31)29-22(33)17(9-14-5-3-2-4-6-14)28-21(32)18(27-19(30)11-23)10-15-12-25-13-26-15/h2-6,12-13,16-18H,7-11,23-24H2,1H3,(H,25,26)(H,27,30)(H,28,32)(H,29,31,33)/t16?,17-,18-,35?/m0/s1
SMILES:
C(NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC1N=CNC=1)NC(=O)CN)(=O)C(N)CCS(C)=O

Butanamide, glycyl-L-histidyl-L-phenylalanyl-4-(methylsulfinyl)-L-2-amino- (9CI)(100642-82-8)物化性质

实验特性

  • 沸点 : 1111.9±65.0 °C(Predicted)
  • 酸度系数(pKa) : 13.10±0.46(Predicted)
  • 密度 : 1.370±0.06 g/cm3(Predicted)