化学式

CAS号

IUPAC Name

3-[[(12S,15S,18S)-7-溴-4-氯-15-[4-[2,2-二氟乙基-[(2-甲基-2-基)oxycarbonyl]氨基]丁基]-18-(3-羟基丙基)-13-甲基-11,14,17-三氧代-2-硫杂-4,10,13,16,19-pentazatricyclo[19.4.0.03,8]pentacosa-1(25),3(8),6,21,23-pentaen-12-基]甲基]吲哚-1-羧酸 3-[[(12S,15S,18S)-7-bromo-4-chloro-15-[4-[2,2-difluoroethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]butyl]-18-(3-hydroxypropyl)-13-methyl-11,14,17-trioxo-2-thia-4,10,13,16,19-pentazatricyclo[19.4.0.03,8]pentacosa-1(25),3(8),6,21,23-pentaen-12-yl]methyl]indole-1-carboxylic acid

InChI

InChI=1S/C44H55BrClF2N7O8S/c1-44(2,3)63-43(62)53(26-37(47)48)19-10-9-14-33-40(59)52(4)35(22-28-25-54(42(60)61)34-16-7-6-13-29(28)34)39(58)50-24-30-31(45)18-20-55(46)41(30)64-36-17-8-5-12-27(36)23-49-32(15-11-21-56)38(57)51-33/h5-8,12-13,16-18,25,32-33,35,37,49,56H,9-11,14-15,19-24,26H2,1-4H3,(H,50,58)(H,51,57)(H,60,61)/t32-,33-,35-/m0/s1

InChI Key

VBAGLTCJISLWTL-BVPJJHLOSA-N

Canonical SMILES

CC(C)(C)OC(=O)N(CCCCC1C(=O)N(C(C(=O)NCC2=C(N(CC=C2Br)Cl)SC3=CC=CC=C3CNC(C(=O)N1)CCCO)CC4=CN(C5=CC=CC=C54)C(=O)O)C)CC(F)F

别名

• SCHEMBL21404794