Chemical Compound

methyl 3-[(21S,22S)-16-[({2-[(2-{[1-(difluoroboranyl)-7-methoxy-3-phenyl-1H,4H,5H-benzo[g]indol-2-yl]imino}-3-phenyl-2H,4H,5H-benzo[g]indol-7-yl)oxy]acetyl}oxy)methyl]-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoate

methyl 3-[(21S,22S)-16-[({2-[(2-{[1-(difluoroboranyl)-7-methoxy-3-phenyl-1H,4H,5H-benzo[g]indol-2-yl]imino}-3-phenyl-2H,4H,5H-benzo[g]indol-7-yl)oxy]acetyl}oxy)methyl]-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoate 结构式
Primary record

methyl 3-[(21S,22S)-16-[({2-[(2-{[1-(difluoroboranyl)-7-methoxy-3-phenyl-1H,4H,5H-benzo[g]indol-2-yl]imino}-3-phenyl-2H,4H,5H-benzo[g]indol-7-yl)oxy]acetyl}oxy)methyl]-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177538480
SMILES
B(N1C2=C(CCC3=C2C=CC(=C3)OC)C(=C1/N=C\4/C(=C5CCC6=C(C5=N4)C=CC(=C6)OCC(=O)OCC7=C(C8=CC9=NC(=C1CC(=O)C2=C1NC(=C2C)C=C1C(=C(C(=N1)C=C7N8)C)CC)[C@H]([C@@H]9C)CCC(=O)OC)C)C1=CC=CC=C1)C1=CC=CC=C1)(F)F
Canonical SMILES
CCC1=C(C)c2cc3[nH]c(cc4nc(c5c6[nH]c(cc1n2)c(C)c6C(=O)C5)[C@@H](CCC(=O)OC)[C@@H]4C)c(C)c3COC(=O)COc1ccc2c(c1)CCC1=C(c3ccccc3)/C(=N/c3c(-c4ccccc4)c4c(n3B(F)F)-c3ccc(OC)cc3CC4)N=C12

名称与同义词

  • J2.853.676C
  • [2-[1-(Difluoroboryl)-7-methoxy-3-phenyl-4,5-dihydro-1H-benzo[g]indole-2-ylimino]-3-phenyl-4,5-dihydro-2H-benzo[g]indole-7-yloxy]acetic acid [(17S,18S)-17-[2-(methoxycarbonyl)ethyl]-131(132H)-oxo-8-ethyl-2,7,12,18-tetramethyl-17,18-dihydro-21H,23H-cyclopenta[mn]porphyrin-3-yl]methyl ester
  • methyl 3-[(21S,22S)-16-[({2-[(2-{[1-(difluoroboranyl)-7-methoxy-3-phenyl-1H,4H,5H-benzo[g]indol-2-yl]imino}-3-phenyl-2H,4H,5H-benzo[g]indol-7-yl)oxy]acetyl}oxy)methyl]-11-ethyl-12,17,21,26-tetramethyl-4-oxo-7,23,24,25-tetraazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaen-22-yl]propanoate