Name: Mal-PEG2-Val-Cit-PABA-PNP
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214322410
Cas No:1345681-52-8
常用名:Mal-PEG2-Val-Cit-PABA-PNP
别名:Mal-PEG2-Val-Cit-PABA-PNP
IUPAC:{4-[(2S)-5-(carbamoylamino)-2-[(2S)-2-[({2-[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethoxy]ethoxy}carbonyl)amino]-3-methylbutanamido]pentanamido]phenyl}methyl 4-nitrophenyl carbonate
IUPAC:{4-[(2S)-5-(carbamoylamino)-2-[(2S)-2-[({2-[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethoxy]ethoxy}carbonyl)amino]-3-methylbutanamido]pentanamido]phenyl}methyl 4-nitrophenyl carbonate
InChI key:VZRMIJHOKYFMIG-WNJJXGMVSA-N

分子式:C34H41N7O13
分子量:755.738
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)[C@H](NC(=O)OCCOCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)Oc2ccc(cc2)N(=O)=O)cc1 |c:16|
SMILES:CC(C)[C@H](NC(=O)OCCOCCN1C(=O)C=CC1=O)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)Oc2ccc(cc2)N(=O)=O)cc1 |c:16|

Mal-PEG2-Val-Cit-PABA-PNP is a cleavable linker compound employed in the synthesis of antibody-drug conjugates (ADCs).

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