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158069-81-9 | Glycine, N,N'-1,2-ethanediylbis[N-[(3,4,5-trimethoxyphenyl)methyl]-
CAS No: 158069-81-9 Catalog No: AG001PYV MDL No:
Product Description
Catalog Number:
AG001PYV
Chemical Name:
Glycine, N,N'-1,2-ethanediylbis[N-[(3,4,5-trimethoxyphenyl)methyl]-
CAS Number:
158069-81-9
Molecular Formula:
C26H36N2O10
Molecular Weight:
536.5714
IUPAC Name:
2-[2-[carboxymethyl-[(3,4,5-trimethoxyphenyl)methyl]amino]ethyl-[(3,4,5-trimethoxyphenyl)methyl]amino]acetic acid
InChI:
InChI=1S/C26H36N2O10/c1-33-19-9-17(10-20(34-2)25(19)37-5)13-27(15-23(29)30)7-8-28(16-24(31)32)14-18-11-21(35-3)26(38-6)22(12-18)36-4/h9-12H,7-8,13-16H2,1-6H3,(H,29,30)(H,31,32)
InChI Key:
WESBWWFIAIZNGR-UHFFFAOYSA-N
SMILES:
COc1cc(CN(CC(=O)O)CCN(Cc2cc(OC)c(c(c2)OC)OC)CC(=O)O)cc(c1OC)OC
Properties
Complexity:
628
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.237g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
536.578g/mol
Monoisotopic Mass:
536.237g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3
Literature
| Title | Journal |
|---|---|
| Iron behaving badly: inappropriate iron chelation as a major contributor to the aetiology of vascular and other progressive inflammatory and degenerative diseases. | BMC medical genomics 20090101 |
| Iron chelation can modulate UVA-induced lipid peroxidation and ferritin expression in human reconstructed epidermis. | Photodermatology, photoimmunology & photomedicine 20040201 |
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