Structure

InChI Key SUHOQUVVVLNYQR-MRVPVSSYSA-N
Smiles C[N+](C)(C)CCOP(=O)([O-])OC[C@H](O)CO
InChI
InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/t8-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H20NO6P
Molecular Weight 257.22
AlogP -1.45
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 99.05
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 16.0

Related Entries

Cross References

Resources Reference
ChEBI 16870
ChEMBL CHEMBL1567463
DrugBank DB04660
DrugCentral 627
FDA SRS 60M22SGW66
PubChem 657272
SureChEMBL SCHEMBL63754