 |
PPF : Summary
Code 
|
PPF
|
One-letter code 
|
X
|
Molecule name 
|
PHOSPHONOFORMIC ACID
|
Systematic names 
|
|
Formula 
|
C H3 O5 P
|
Formal charge 
|
0
|
Molecular weight 
|
126.005 Da
|
SMILES 
|
Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(O)P(=O)(O)O |
SMILES
|
CACTVS |
3.341 |
OC(=O)[P](O)(O)=O |
SMILES
|
OpenEye OEToolkits |
1.5.0 |
C(=O)(O)P(=O)(O)O |
Canonical SMILES
|
CACTVS |
3.341 |
OC(=O)[P](O)(O)=O |
Canonical SMILES
|
OpenEye OEToolkits |
1.5.0 |
C(=O)(O)P(=O)(O)O |
|
IUPAC InChI  | InChI=1S/CH3O5P/c2-1(3)7(4,5)6/h(H,2,3)(H2,4,5,6) |
IUPAC InChI key  | ZJAOAACCNHFJAH-UHFFFAOYSA-N |
|
wwPDB Information |
Atom count 
|
10 (7 without Hydrogen)
|
Polymer type 
|
Bound ligand
|
Type description 
|
NON-POLYMER
|
Type code 
|
HETAIN
|
Is modified 
|
No
|
Standard parent 
|
Not Assigned
|
Defined at 
|
2000-03-09
|
Last modified at 
|
2011-06-04
|
Status 
|
Released
|
Obsoleted 
|
Not Assigned
|
|