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Chemical structure of Z-Asp-Gln-Met-Asp-AFC

GA23727

Z-Asp-Gln-Met-Asp-AFC

Also known as (3S)-3-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-3-carboxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]-5-oxopentanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-oxo-4-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]amino]butanoic acid

Ac-DQMD-AFC, fluorogenic substrate for caspase-3· It contains the DQMD peptide sequence of the baculovirus caspase inhibitor p35

ChemicalCAS1926163-45-2MW852.8FormulaC36H39F3N6O13S
CAS number
1926163-45-2
Molecular weight
852.8
Formula
C36H39F3N6O13S
Solubility
Soluble in DMSO
InChIKey
XKIGABBVUWYUSS-QORCZRPOSA-N
Catalogue number
GA23727
Brand
GLPBIO
Computed properties PubChem CID 99647839 · XLogP 0.1 · TPSA 324 Ų · H-bond donors 8
XLogP
0.1
TPSA
324 Ų
H-bond donors
8
H-bond acceptors
17
Rotatable bonds
22
Heavy atoms
59

SMILES CSCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)OCC3=CC=CC=C3

Computed descriptors from PubChem (CID 99647839), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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