FSG
Summary
Name: | [(1S)-1-FLUORO-2-(HYDROXYAMINO)-2-OXOETHYL]PHOSPHONIC ACID |
Formula: | C2 H5 F N O5 P |
Formal charge: | 0 |
Formula weight: | 173.037 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | [(1S)-1-fluoro-2-(hydroxyamino)-2-oxoethyl]phosphonic acid |
OpenEye OEToolkits | 1.5.0 | [(1S)-1-fluoro-2-(hydroxyamino)-2-oxo-ethyl]phosphonic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(NO)C(F)P(=O)(O)O |
SMILES_CANONICAL | CACTVS | 3.341 | ONC(=O)[C@@H](F)[P](O)(O)=O |
SMILES | CACTVS | 3.341 | ONC(=O)[CH](F)[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [C@H](C(=O)NO)(F)P(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C(=O)NO)(F)P(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C2H5FNO5P/c3-1(2(5)4-6)10(7,8)9/h1,6H,(H,4,5)(H2,7,8,9)/t1-/m0/s1 |
InChIKey | InChI | 1.03 | PDPXHRBRYUQCQA-SFOWXEAESA-N |