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Chemical structure of MC-Val-Ala-PAB-PNP

GC62039

MC-Val-Ala-PAB-PNP

Also known as [4-[[(2S)-2-[[(2S)-2-[6-(2,5-dioxopyrrol-1-yl)hexanoylamino]-3-methylbutanoyl]amino]propanoyl]amino]phenyl]methyl (4-nitrophenyl) carbonate

MC-Val-Ala-PAB-PNP is a cleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs)

ChemicalCAS1639939-40-4MW651.66FormulaC32H37N5O10
CAS number
1639939-40-4
Molecular weight
651.66
Formula
C32H37N5O10
InChIKey
QXMLUPPUFBNKRY-LGGPFLRQSA-N
Catalogue number
GC62039
Brand
GLPBIO
Computed properties PubChem CID 100029269 · XLogP 3.3 · TPSA 206 Ų · H-bond donors 3
XLogP
3.3
TPSA
206 Ų
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
17
Heavy atoms
47

SMILES C[C@@H](C(=O)NC1=CC=C(C=C1)COC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)[C@H](C(C)C)NC(=O)CCCCCN3C(=O)C=CC3=O

Computed descriptors from PubChem (CID 100029269), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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