Comprehensive Medicinal Plant Database

Compound data

Compound nameLiquiritin(リクイリチン)
AliasLiquiritoside, (2S)-2,3-Dihydro-7-hydroxy-2-[4-(β-D-glucopyranosyloxy)phenyl]-4H-1-benzopyran-4-one
Structure
liquiritin.mol
Molecular formulaC21H22O9
Molecular weight418.399
IUPAC(2S)-7-hydroxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one
CAS551-15-5
Other DB
CHEBI
CHEMPDB
KEGGC16989
NIKKAJIJ22.605J
PUBCHEMCID:503737
Reference
NMR data list 
TypeMachine name
1H-NMR日本電子　ECS400
13C-NMRJEOL　ECA600
1H-NMRJEOL　ECA600
(LC/GC)MS data list 
Serial Number（LC/GC name）LC/GC dataMS data
NIB-1179LC(ESI-Orbitrap(+))MS
NIB-1180LC(ESI-Orbitrap(+))MS
NIB-1181LC(ESI-Orbitrap(+))MS
NIB-1182LC(ESI-Orbitrap(+))MS
NIB-1183LC(ESI-Orbitrap(+))MS
NIB-1184LC(ESI-Orbitrap(+))MS
NIB-1185LC(ESI-Orbitrap(+))MS
NIB-1179LC(ESI-Orbitrap(-))MS
NIB-1180LC(ESI-Orbitrap(-))MS
NIB-1181LC(ESI-Orbitrap(-))MS
NIB-1182LC(ESI-Orbitrap(-))MS
NIB-1183LC(ESI-Orbitrap(-))MS
NIB-1184LC(ESI-Orbitrap(-))MS
NIB-1185LC(ESI-Orbitrap(-))MS
Crude drug(s) include this compound GLYCYRRHIZAE RADIX