AC1LX3B9 structure

AC1LX3B9

(2S)-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-phenylpropanoic acid

Also Known As: EiM07-17006|AB00864273-06|N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-phenylalanine|(2S)-2-({2-[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)-3-phenylpropanoic acid|(2S)-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-phenylpropanoic acid|(S)-2-(2-((3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-phenylpropanoic acid|2-[[2-(3,4-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-phenyl-propanoic Acid

CAS: 956958-49-9
Molecular Formula C22H21NO6
Molecular Weight 395.1369 g/mol
LogP 2.60074
Topological Polar Surface Area 105.84 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 395.1369
Monoisotopic Mass 395.1369
Heavy Atoms 29
Complexity 1103.4807

Chemical Identifiers

CAS Number 956958-49-9
SMILES CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)C

Product Overview

AC1LX3B9 (CAS 956958-49-9), with molecular formula C22H21NO6 and molecular weight 395.1369 g/mol. IUPAC: (2S)-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-phenylpropanoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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