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875430-16-3 | Glycine, N-[(4-hydroxyphenyl)methyl]-N-[(4-methoxyphenoxy)carbonyl]-
CAS No: 875430-16-3 Catalog No: AG004H2A MDL No:
Product Description
Catalog Number:
AG004H2A
Chemical Name:
Glycine, N-[(4-hydroxyphenyl)methyl]-N-[(4-methoxyphenoxy)carbonyl]-
CAS Number:
875430-16-3
Molecular Formula:
C17H17NO6
Molecular Weight:
331.3200
IUPAC Name:
2-[(4-hydroxyphenyl)methyl-(4-methoxyphenoxy)carbonylamino]acetic acid
InChI:
InChI=1S/C17H17NO6/c1-23-14-6-8-15(9-7-14)24-17(22)18(11-16(20)21)10-12-2-4-13(19)5-3-12/h2-9,19H,10-11H2,1H3,(H,20,21)
InChI Key:
GQHGGKPOZFTGOJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OC(=O)N(Cc1ccc(cc1)O)CC(=O)O
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.106g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
331.324g/mol
Monoisotopic Mass:
331.106g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
96.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Comparative metabolism of radiolabeled muraglitazar in animals and humans by quantitative and qualitative metabolite profiling. | Drug metabolism and disposition: the biological fate of chemicals 20070101 |
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