Structure

InChI Key UDKCHVLMFQVBAA-UHFFFAOYSA-M
Smile C[N+](C)(C)CCO.O=C([O-])c1ccccc1O
InChI
InChI=1S/C7H6O3.C5H14NO/c8-6-4-2-1-3-5(6)7(9)10;1-6(2,3)4-5-7/h1-4,8H,(H,9,10);7H,4-5H2,1-3H3/q;+1/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H19NO4
Molecular Weight 241.29
AlogP None
Hydrogen Bond Acceptor None
Hydrogen Bond Donor None
Number of Rotational Bond None
Polar Surface Area None
Molecular species None
Aromatic Rings None
Heavy Atoms None

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Cross References

Resources Reference
ChEBI 3668
ChEMBL CHEMBL2104095
DrugBank DB14006
EPA CompTox DTXSID8062103
FDA SRS KD510K1IQW
PubChem 54686350
SureChEMBL SCHEMBL3960