SXE
Summary
| Name: | O-{(S)-ETHOXY[(1-METHYLETHYL)AMINO]PHOSPHORYL}-L-SERINE |
| Formula: | C8 H19 N2 O5 P |
| Formal charge: | 0 |
| Formula weight: | 254.221 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | O-{(S)-ethoxy[(1-methylethyl)amino]phosphoryl}-L-serine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-[ethoxy-(propan-2-ylamino)phosphoryl]oxy-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(OCC)(OCC(N)C(=O)O)NC(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCO[P@@](=O)(NC(C)C)OC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.341 | CCO[P](=O)(NC(C)C)OC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCO[P@@](=O)(NC(C)C)OC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCOP(=O)(NC(C)C)OCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H19N2O5P/c1-4-14-16(13,10-6(2)3)15-5-7(9)8(11)12/h6-7H,4-5,9H2,1-3H3,(H,10,13)(H,11,12)/t7-,16-/m0/s1 |
| InChIKey | InChI | 1.03 | QLERCZZJSHOCQX-GYKQLYQFSA-N |
