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Chemical structure of N-[(RS)-1-Carboxy-3-phenyl-propyl]-Ala-Ala-Phe-4-Abz-OH

GA23221

N-[(RS)-1-Carboxy-3-phenyl-propyl]-Ala-Ala-Phe-4-Abz-OH

Also known as 4-[[(2S)-1-[[(2S)-2-[[(2S)-2-[(1-carboxy-3-phenylpropyl)amino]propanoyl]amino]propanoyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]benzoic acid

Specific inhibitor of thimet oligopeptidase (soluble metalloendopeptidase, EC 3·4·24·15) (Ki = 0·027 ± 0·003 &#181M)· Neprilysin (Endopeptidase-2, EC 3·4·24·11) converts Cpp-AAF-pAb into a potent inhibitor of angiotensin-converting enzyme (ACE)

ChemicalCAS116560-97-5MW588.66FormulaC32H36N4O7
CAS number
116560-97-5
Molecular weight
588.66
Formula
C32H36N4O7
Solubility
Soluble in DMSO
InChIKey
UZKWDJFXHHHJFU-FFXSJNGMSA-N
Catalogue number
GA23221
Brand
GLPBIO
Computed properties PubChem CID 5748203 · XLogP 2 · TPSA 174 Ų · H-bond donors 6
XLogP
2
TPSA
174 Ų
H-bond donors
6
H-bond acceptors
9
Rotatable bonds
15
Heavy atoms
43

SMILES C[C@@H](C(=O)N[C@@H](C)C(=O)NC(=O)[C@H](CC1=CC=CC=C1)NC2=CC=C(C=C2)C(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

Computed descriptors from PubChem (CID 5748203), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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