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2644-49-7 | 5-Isoxazolidineacetic acid, α-amino-3-oxo-, (αR,5R)-rel-
CAS No: 2644-49-7 Catalog No: AG002T8H MDL No:
Product Description
Catalog Number:
AG002T8H
Chemical Name:
5-Isoxazolidineacetic acid, α-amino-3-oxo-, (αR,5R)-rel-
CAS Number:
2644-49-7
Molecular Formula:
C5H8N2O4
Molecular Weight:
160.1280
IUPAC Name:
2-amino-2-(3-oxo-1,2-oxazolidin-5-yl)acetic acid
InChI:
InChI=1S/C5H8N2O4/c6-4(5(9)10)2-1-3(8)7-11-2/h2,4H,1,6H2,(H,7,8)(H,9,10)
InChI Key:
NTHMUJMQOXQYBR-UHFFFAOYSA-N
SMILES:
O=C1NO[C@H](C1)[C@H](C(=O)O)N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
160.129g/mol
Monoisotopic Mass:
160.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.2
Literature
| Title | Journal |
|---|---|
| Synthesis and pharmacological characterization at glutamate receptors of the four enantiopure isomers of tricholomic acid. | Journal of medicinal chemistry 20080410 |
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