129
Summary
Name: | [2(FORMYL-HYDROXY-AMINO)-ETHYL]-PHOSPHONIC ACID |
Formula: | C3 H8 N O5 P |
Formal charge: | 0 |
Formula weight: | 169.073 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | {2-[formyl(hydroxy)amino]ethyl}phosphonic acid |
OpenEye OEToolkits | 1.5.0 | 2-(hydroxy-methanoyl-amino)ethylphosphonic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(O)CCN(O)C=O |
SMILES_CANONICAL | CACTVS | 3.341 | ON(CC[P](O)(O)=O)C=O |
SMILES | CACTVS | 3.341 | ON(CC[P](O)(O)=O)C=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CP(=O)(O)O)N(C=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CP(=O)(O)O)N(C=O)O |
InChI | InChI | 1.03 | InChI=1S/C3H8NO5P/c5-3-4(6)1-2-10(7,8)9/h3,6H,1-2H2,(H2,7,8,9) |
InChIKey | InChI | 1.03 | NBAIGNUEKZLOMI-UHFFFAOYSA-N |