Phenobarbital-N-glucoside

5-ethyl-5-phenyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione

Also Known As: 1-Gppb|Phenobarbital-N-glucoside|Phenobarbital N-?-D-Glucoside|Phenobarbital N-b-D-Glucoside|(S)-Phenobarbitone N-glucoside|Phenobarbital N-|A-D-Glucoside|1-|A-D-Glucopyranosylphenobarbital|1-beta-D-Glucopyranosylphenobarbital|1-(beta-D-Glucopyranosyl)phenobarbital|PHENOBARBITAL N-BETA-D-GLUCOSIDE|5-Ethyl-1-beta-D-glucopyranosyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione|5-ethyl-5-phenyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,3-diazinane-2,4,6-trione|Phenobarbital N-b-D-Glucoside (1.0mg/ml in Acetonitrile)|Phenobarbital N-beta-D-Glucoside (1 mg/ml in Acetonitrile)|2,4,6(1h,3h,5h)-pyrimidinetrione, 5-ethyl-1-|A-d-glucopyranosyl-5-phenyl-|(1S)-1-(beta-D-Glucopyranosyl)-5-ethyl-5-phenylbarbituric acid|5-ethyl-1-|A-D-glucopyranosyl-5-phenyl-2,4,6-(1H,3H,5H)pyrimidinetrione|5-Ethyl-1-D-glucopyranosyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione|2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-beta-D-glucopyranosyl-5-phenyl-|5-Ethyl-1-(1-beta-glucopyranosyl)-5-phenyl-2,4,6-(1H,3H,5H)pyrimidinetrione|5-Ethyl-1-D-glucopyranosyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione; 1-beta-D-Glucopyranosylphenobarbital;

Molecular Formula	C18H22N2O8
Molecular Weight	394.1376 g/mol
LogP	-1.79
Topological Polar Surface Area	156.63 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	8
Rotatable Bonds	4
Exact Mass	394.1376
Heavy Atoms	28
Complexity	770.1

Chemical Identifiers

CAS Number	72209-10-0
SMILES	CCC1(C(=O)NC(=O)N(C1=O)[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C3=CC=CC=C3