Name: PC5-VC-PAB-MMAE
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT218832685
Cas No:
常用名:PC5-VC-PAB-MMAE
IUPAC:2,3,4,5,6-pentafluorophenyl 4-[(1-{[4-(carbamoylamino)-1-[(4-{[({1-[(1-{[1-(2-{2-[(1-hydroxy-1-phenylpropan-2-yl)carbamoyl]-1-methoxy-2-methylethyl}pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl](methyl)carbamoyl}-2-methylpropyl)carbamoyl]-2-methylpropyl}(methyl)carbamoyl)oxy]methyl}phenyl)carbamoyl]butyl]carbamoyl}-2-methylpropyl)carbamoyl]butanoate
IUPAC:2,3,4,5,6-pentafluorophenyl 4-[(1-{[4-(carbamoylamino)-1-[(4-{[({1-[(1-{[1-(2-{2-[(1-hydroxy-1-phenylpropan-2-yl)carbamoyl]-1-methoxy-2-methylethyl}pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl](methyl)carbamoyl}-2-methylpropyl)carbamoyl]-2-methylpropyl}(methyl)carbamoyl)oxy]methyl}phenyl)carbamoyl]butyl]carbamoyl}-2-methylpropyl)carbamoyl]butanoate
InChI key:ZZSMZLNVMAIJOK-UHFFFAOYSA-N

分子式:C69H99F5N10O15
分子量:1403.598
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(C)C(O)c1ccccc1)OC)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C(=O)OCc1ccc(NC(=O)C(CCCNC(N)=O)NC(=O)C(NC(=O)CCCC(=O)Oc2c(F)c(F)c(F)c(F)c2F)C(C)C)cc1)C(C)C
SMILES:CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(C)C(O)c1ccccc1)OC)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C(=O)OCc1ccc(NC(=O)C(CCCNC(N)=O)NC(=O)C(NC(=O)CCCC(=O)Oc2c(F)c(F)c(F)c(F)c2F)C(C)C)cc1)C(C)C

PC5-VC-PAB-MMAE 是由 ADC linker(PC5-VC-PAB) 与 MMAE 构成，后者为一种高效的微管(tubulin)抑制剂。该化合物主要用于抗体偶联。

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