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Chemical structure of D-Ala-Lys-AMCA hydrochloride

GC38504

D-Ala-Lys-AMCA hydrochloride

Also known as (2S)-6-[[2-(7-amino-4-methyl-2-oxochromen-3-yl)acetyl]amino]-2-[[(2R)-2-aminopropanoyl]amino]hexanoic acid;hydrochloride

D-Ala-Lys-AMCA hydrochloride is a known proton-coupled oligopeptide transporter 1 (PEPT1) substrate that emits blue fluorescence· D-Ala-Lys-AMCA hydrochloride may be transported into liver cancer cells and Caco-2 cells based on fluorescence analysis

ChemicalCAS2703746-41-0MW468.93FormulaC21H29ClN4O6
CAS number
2703746-41-0
Molecular weight
468.93
Formula
C21H29ClN4O6
Solubility
Water: 100 mg/mL (213·25 mM); DMSO: 14·71 mg/mL (31·37 mM)
InChIKey
CUYFZQGMNMFDIC-KKJWGQAZSA-N
Catalogue number
GC38504
Brand
GLPBIO
Computed properties PubChem CID 139600271 · TPSA 174 Ų · H-bond donors 6 · H-bond acceptors 8
TPSA
174 Ų
H-bond donors
6
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
32

SMILES CC1=C(C(=O)OC2=C1C=CC(=C2)N)CC(=O)NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](C)N.Cl

Computed descriptors from PubChem (CID 139600271), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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