Keyword(s): Human Metabolites
Molecule Category Free-form
UNII ZX4PWG857L

Structure

InChI Key LFLUCDOSQPJJBE-UHFFFAOYSA-N
Smiles OC(=O)C(=O)CO[P](O)(O)=O
InChI
InChI=1S/C3H5O7P/c4-2(3(5)6)1-10-11(7,8)9/h1H2,(H,5,6)(H2,7,8,9)

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H5O7P1
Molecular Weight 183.98
AlogP -1.25
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 121.13
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 3913-50-6
NORMAN SUSDAT
FDA SRS ZX4PWG857L