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

Structure

InChI Key UTCHNZLBVKHYKC-UHFFFAOYSA-N
Smiles OC(C(O)=O)[P](O)(O)=O
InChI
InChI=1S/C2H5O6P/c3-1(4)2(5)9(6,7)8/h2,5H,(H,3,4)(H2,6,7,8)

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H5O6P1
Molecular Weight 155.98
AlogP -1.43
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 2.0
Polar Surface Area 115.06
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 23783-26-8
NORMAN SUSDAT