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134052-73-6 | (S)-4-(amino(carboxy)methyl)benzoic acid
CAS No: 134052-73-6 Catalog No: AG00392F MDL No:MFCD00216831
Product Description
Catalog Number:
AG00392F
Chemical Name:
(S)-4-(amino(carboxy)methyl)benzoic acid
CAS Number:
134052-73-6
Molecular Formula:
C9H9NO4
Molecular Weight:
195.1721
MDL Number:
MFCD00216831
IUPAC Name:
4-[(S)-amino(carboxy)methyl]benzoic acid
InChI:
InChI=1S/C9H9NO4/c10-7(9(13)14)5-1-3-6(4-2-5)8(11)12/h1-4,7H,10H2,(H,11,12)(H,13,14)/t7-/m0/s1
InChI Key:
VTMJKPGFERYGJF-ZETCQYMHSA-N
SMILES:
N[C@@H](c1ccc(cc1)C(=O)O)C(=O)O
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
195.053g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
195.174g/mol
Monoisotopic Mass:
195.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2
Literature
| Title | Journal |
|---|---|
| Inhibition of xc⁻ transporter-mediated cystine uptake by sulfasalazine analogs. | Bioorganic & medicinal chemistry letters 20111015 |
| Conformationally-restricted amino acid analogues bearing a distal sulfonic acid show selective inhibition of system x(c)(-) over the vesicular glutamate transporter. | Bioorganic & medicinal chemistry letters 20100415 |
| Discovery and biological profile of 4-(1-aryltriazol-4-yl)-tetrahydropyridines as an orally active new class of metabotropic glutamate receptor 1 antagonist. | Bioorganic & medicinal chemistry 20081115 |
| [3H]R214127: a novel high-affinity radioligand for the mGlu1 receptor reveals a common binding site shared by multiple allosteric antagonists. | Molecular pharmacology 20030501 |
| Common and selective molecular determinants involved in metabotopic glutamate receptor agonist activity. | Journal of medicinal chemistry 20020718 |
| Characterization of [(3)H]Quisqualate binding to recombinant rat metabotropic glutamate 1a and 5a receptors and to rat and human brain sections. | Journal of neurochemistry 20001201 |
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