Name: calcium;(3R)-3-hydroxy-4-(trimethylazaniumyl)butanoate;bis(2-propylpentanoate)

SMILES: CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].C[N+](C)(C)CC(CC(=O)[O-])O.[Ca+2]

Molecular Processing

Molecular formula

C23H45CaNO7

Molecular weight

487.69

Exact mass

487.2822

XLogP

-0.28

TPSA

140.62

H-bond donors

H-bond acceptors

Rotatable bonds

Heavy atoms

Rings

Aromatic rings

Saturated rings

Aliphatic rings

Stereo centers

Undefined stereo

Formal charge

Heteroatoms

Covalent units

Fraction Csp3

0.87

Molar refractivity

120.91

Supplementary Information

InChIKey: BWAGOGGUGSGERA-ZGOHZKFSSA-L

Synonyme

L-carnitine calcium valproateBWAGOGGUGSGERA-ZGOHZKFSSA-L