Molecular Identity
betaine
2-(trimethylazaniumyl)acetate
PubChem CID: 247
Glycine betaine is the amino acid betaine derived from glycine. It has a role as a fundamental metabolite. It is an amino-acid betaine and a glycine derivative. It is a conjugate base of a N,N,N-trimethylglycinium.
2D Structure
Properties
C5H11NO2
Molecular Formula
117.15
Molecular Weight
g/mol
117.0790
Exact Mass
Da
0.5
XLogP
Drug-like (Lipinski: < 5)
40.1
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
2
H-Bond Acceptors
87
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
betaine107-43-7glycine betaineoxyneurineTrimethylglycinelycineAbromineTrimethylglycocollGlycocoll betaineGlycylbetaineRubrine C2-(trimethylazaniumyl)acetate2-(Trimethylammonio)AcetateJortaineBETAINE, ANHYDROUS
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to betaine
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