| PDB CCD ID: | HH3 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C9 H9 N O4 |
| InChI: | InChI=1S/C9H9NO4/c11-7(10-8(12)9(13)14)6-4-2-1-3-5-6/h1-5,8,12H,(H,10,11)(H,13,14)/t8-/m0/s1 |
| InChIKey: | GCWCVCCEIQXUQU-QMMMGPOBSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | c1ccc(cc1)C(=O)N[C@H](C(=O)O)O | | ACDLabs 10.04 | O=C(NC(O)C(=O)O)c1ccccc1 | | OpenEye OEToolkits 1.5.0 | c1ccc(cc1)C(=O)NC(C(=O)O)O | | CACTVS 3.341 | O[CH](NC(=O)c1ccccc1)C(O)=O | | CACTVS 3.341 | O[C@H](NC(=O)c1ccccc1)C(O)=O |
|
| Name: | (2S)-hydroxy[(phenylcarbonyl)amino]ethanoic acid;
alpha-hydroxyhippuric acid |
| ZINC: | ZINC000000119975 |
umich.edu