5TX
Summary
| Name: | ((3S,5S)-1,5-dihydroxy-3-methyl-2-oxopyrrolidin-3-yl)phosphonic acid |
| Formula: | C5 H10 N O6 P |
| Formal charge: | 0 |
| Formula weight: | 211.11 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | [(3~{S},5~{S})-3-methyl-1,5-bis(oxidanyl)-2-oxidanylidene-pyrrolidin-3-yl]phosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H10NO6P/c1-5(13(10,11)12)2-3(7)6(9)4(5)8/h3,7,9H,2H2,1H3,(H2,10,11,12)/t3-,5-/m0/s1 |
| InChIKey | InChI | 1.03 | VVBLYPMICKYZTP-UCORVYFPSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@]1(C[C@H](O)N(O)C1=O)[P](O)(O)=O |
| SMILES | CACTVS | 3.385 | C[C]1(C[CH](O)N(O)C1=O)[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | C[C@@]1(C[C@@H](N(C1=O)O)O)P(=O)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.4 | CC1(CC(N(C1=O)O)O)P(=O)(O)O |
