TX4
Summary
| Name: | L-THREONOHYDROXAMATE 4-PHOSPHATE |
| Formula: | C4 H12 N O8 P |
| Formal charge: | 0 |
| Formula weight: | 233.114 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S,3R,4S)-2,3,4-trihydroxy-4-(hydroxyamino)butyl dihydrogen phosphate |
| OpenEye OEToolkits | 1.5.0 | [(2S,3R)-2,3,4-trihydroxy-4-(hydroxyamino)butyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)OCC(O)C(O)C(O)NO |
| SMILES_CANONICAL | CACTVS | 3.341 | ON[C@@H](O)[C@H](O)[C@@H](O)CO[P](O)(O)=O |
| SMILES | CACTVS | 3.341 | ON[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H]([C@H](C(NO)O)O)O)OP(=O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(C(NO)O)O)O)OP(=O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C4H12NO8P/c6-2(1-13-14(10,11)12)3(7)4(8)5-9/h2-9H,1H2,(H2,10,11,12)/t2-,3+,4-/m0/s1 |
| InChIKey | InChI | 1.03 | CSVKNYIFCYRDJM-NUNKFHFFSA-N |
