| PDB CCD ID: | 2ZC |
| Number of entries in BioLiP: | 0 |
| Chemical formula: | C11 H16 N2 O5 S |
| InChI: | InChI=1S/C11H16N2O5S/c12-6-5-8-1-3-9(4-2-8)19(16,17)18-7-10(13)11(14)15/h1-4,10H,5-7,12-13H2,(H,14,15)/t10-/m0/s1 |
| InChIKey: | GYATUUIUJIKHFE-JTQLQIEISA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | O=C(O)C(N)COS(=O)(=O)c1ccc(cc1)CCN | | CACTVS 3.385 | NCCc1ccc(cc1)[S](=O)(=O)OC[C@H](N)C(O)=O | | OpenEye OEToolkits 1.7.6 | c1cc(ccc1CCN)S(=O)(=O)OCC(C(=O)O)N | | OpenEye OEToolkits 1.7.6 | c1cc(ccc1CCN)S(=O)(=O)OC[C@@H](C(=O)O)N | | CACTVS 3.385 | NCCc1ccc(cc1)[S](=O)(=O)OC[CH](N)C(O)=O |
|
| Name: | O-{[4-(2-aminoethyl)phenyl]sulfonyl}-L-serine |
| ZINC: | ZINC000098208362 |
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