Showing Metabocard for 3-hydroxypyruvate (BASm0000876)
Common Name | 3-hydroxypyruvate |
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Description | Not Available |
Structure | |
Molecular Formula | C3H3O4 |
Average Mass | 103.05400 |
Monoisotopic Mass | 103.00368 |
IUPAC Name | 3-hydroxy-2-oxopropanoic acid |
Traditional Name | 3-hydroxypyruvic acid |
CAS Registry Number | Not Available |
SMILES | O=C([O-])C(=O)CO |
InChI Identifier | InChI=1S/C3H4O4/c4-1-2(5)3(6)7/h4H,1H2,(H,6,7)/p-1 |
InChI Key | HHDDCCUIIUWNGJ-UHFFFAOYSA-M |
CHEBI ID | CHEBI:17180 |
MiMeDB ID | MMDBc0055385 |
State | Expected Solid |
Water Solubility | 2.09e+02 g/l |
logP | -1.43 |
logS | 0.30 |
pKa (Strongest Acidic) | 2.57 |
pKa (Strongest Basic) | -3.39 |
Hydrogen Acceptor Count | 4 |
Hydrogen Donor Count | 2 |
Polar Surface Area | 74.6 Ų |
Rotatable Bond Count | 2 |
Physiological Charge | -1 |
Formal Charge | 0 |
Refractivity | 19.69 m³·mol⁻¹ |
Polarizability | 8.18 |