SUN
Summary
| Name: | O-[(R)-(DIMETHYLAMINO)(ETHOXY)PHOSPHORYL]-L-SERINE |
| Synonyms: | TABUN CONJUGATED SERINE |
| Formula: | C7 H17 N2 O5 P |
| Formal charge: | 0 |
| Formula weight: | 240.194 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | O-[(R)-(dimethylamino)(ethoxy)phosphoryl]-L-serine |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(dimethylamino-ethoxy-phosphoryl)oxy-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(OCC)(OCC(N)C(=O)O)N(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCO[P@@](=O)(OC[C@H](N)C(O)=O)N(C)C |
| SMILES | CACTVS | 3.341 | CCO[P](=O)(OC[CH](N)C(O)=O)N(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCO[P@](=O)(N(C)C)OC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCOP(=O)(N(C)C)OCC(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C7H17N2O5P/c1-4-13-15(12,9(2)3)14-5-6(8)7(10)11/h6H,4-5,8H2,1-3H3,(H,10,11)/t6-,15+/m0/s1 |
| InChIKey | InChI | 1.03 | RIJCTVRGPFRGFH-WDDATRMLSA-N |
