K8P
Summary
| Name: | [(2~{R},3~{R})-2,3-bis(oxidanyl)-3-[[(2~{S})-3-oxidanylidenepent-4-en-2-yl]amino]propyl] dihydrogen phosphate |
| Formula: | C8 H16 N O7 P |
| Formal charge: | 0 |
| Formula weight: | 269.189 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | [(2~{R},3~{R})-2,3-bis(oxidanyl)-3-[[(2~{S})-3-oxidanylidenepent-4-en-2-yl]amino]propyl] dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H16NO7P/c1-3-6(10)5(2)9-8(12)7(11)4-16-17(13,14)15/h3,5,7-9,11-12H,1,4H2,2H3,(H2,13,14,15)/t5-,7+,8+/m0/s1 |
| InChIKey | InChI | 1.03 | UJGBYPNOGNUCKJ-UIISKDMLSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](N[C@H](O)[C@H](O)CO[P](O)(O)=O)C(=O)C=C |
| SMILES | CACTVS | 3.385 | C[CH](N[CH](O)[CH](O)CO[P](O)(O)=O)C(=O)C=C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | C[C@@H](C(=O)C=C)N[C@@H]([C@@H](COP(=O)(O)O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.5 | CC(C(=O)C=C)NC(C(COP(=O)(O)O)O)O |
