SPARTEINE SULPHATE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII GQ3J2TLZ7E

Structure

InChI Key FCEHFCFHANDXMB-UMEYXWOPSA-N
Smiles OS(=O)(=O)O.C1CCN2C[C@@H]3C[C@@H](CN4CCCC[C@@H]34)[C@H]2C1
InChI
InChI=1/C15H26N2.H2O4S/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17;1-5(2,3)4/h12-15H,1-11H2;(H2,1,2,3,4)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H28N2O4S
Molecular Weight 332.18
AlogP 1.69
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Polar Surface Area 81.08
Heavy Atoms 22.0

Cross References

Resources Reference
CAS NUMBER 299-39-8
NORMAN SUSDAT
FDA SRS GQ3J2TLZ7E
CONTENTS