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Chemical structure of Mal-PEG4-VC-PAB-DMEA

GC63400

Mal-PEG4-VC-PAB-DMEA

Also known as [4-[[(2S)-5-(carbamoylamino)-2-[[(2S)-2-[3-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]-3-methylbutanoyl]amino]pentanoyl]amino]phenyl]methyl N-methyl-N-[2-(methylamino)ethyl]carbamate

Mal-PEG4-VC-PAB-DMEA is a cleavable ADC linker containing a Maleimide group· Mal-PEG4-VC-PAB-DMEA is used in the synthesis of antibody-drug conjugates (ADCs)

ChemicalCAS1569261-93-3MW892.01FormulaC41H65N9O13
CAS number
1569261-93-3
Molecular weight
892.01
Formula
C41H65N9O13
InChIKey
LWZJKFNULKGJGO-OCZFFWILSA-N
Catalogue number
GC63400
Brand
GLPBIO
Computed properties PubChem CID 145712362 · XLogP -2.2 · TPSA 287 Ų · H-bond donors 7
XLogP
-2.2
TPSA
287 Ų
H-bond donors
7
H-bond acceptors
14
Rotatable bonds
34
Heavy atoms
63

SMILES CC(C)[C@@H](C(=O)N[C@@H](CCCNC(=O)N)C(=O)NC1=CC=C(C=C1)COC(=O)N(C)CCNC)NC(=O)CCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O

Computed descriptors from PubChem (CID 145712362), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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