PDB CCD ID: | 0UZ |
Number of entries in BioLiP: | 0 |
Chemical formula: | C8 H8 Cl N O3 |
InChI: | InChI=1S/C8H8ClNO3/c9-5-3-4(1-2-6(5)11)7(10)8(12)13/h1-3,7,11H,10H2,(H,12,13)/t7-/m1/s1 |
InChIKey: | FLZDFFKRJPLFGS-SSDOTTSWSA-N |
SMILES: | Software | SMILES |
---|
ACDLabs 12.01 | Clc1cc(ccc1O)C(C(=O)O)N | OpenEye OEToolkits 1.7.6 | c1cc(c(cc1C(C(=O)O)N)Cl)O | OpenEye OEToolkits 1.7.6 | c1cc(c(cc1[C@H](C(=O)O)N)Cl)O | CACTVS 3.370 | N[CH](C(O)=O)c1ccc(O)c(Cl)c1 | CACTVS 3.370 | N[C@@H](C(O)=O)c1ccc(O)c(Cl)c1 |
|
Name: | (2R)-amino(3-chloro-4-hydroxyphenyl)ethanoic acid |
ZINC: | ZINC000008377559 |