PVO
2,2-bis(oxidanyl)propanoic acid
Created: | 2016-08-23 |
Last modified: | 2024-09-27 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 13 |
Chiral Atom Count | 0 |
Bond Count | 12 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
---|---|
Name | 2,2-bis(oxidanyl)propanoic acid |
Systematic Name (OpenEye OEToolkits) | 2,2-bis(oxidanyl)propanoic acid |
Formula | C3 H6 O4 |
Molecular Weight | 106.077 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CC(O)(O)C(O)=O |
SMILES | OpenEye OEToolkits | 2.0.5 | CC(C(=O)O)(O)O |
Canonical SMILES | CACTVS | 3.385 | CC(O)(O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 2.0.5 | CC(C(=O)O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C3H6O4/c1-3(6,7)2(4)5/h6-7H,1H3,(H,4,5) |
InChIKey | InChI | 1.03 | HPQUMJNDQVOTAZ-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 160595 |