MetaADEDB 2.0 @ LMMD
ligustilide
(IQVQXVFMNOFTMU-FLIBITNWSA-N)
Structure
SMILES
CCC/C=C/1\OC(=O)C2=C1CCC=C2
Molecular Formula:
C12H14O2
Molecular Weight:
190.238
Log P:
2.8738
Hydrogen Bond Acceptor:
2
Hydrogen Bond Donor:
0
TPSA:
26.3
CAS Number(s):
4431-01-0; 81944-09-4
Synonym(s)
1.
ligustilide
2.
Z-ligustilide
3.
ligustilide, (E)-isomer
4.
ligustilide, (Z)-isomer
External Link(s)
MeSHC027820
PubChem Compound5319022
BindingDB50441016
ChEBI68232
CHEMBLCHEMBL481246
KEGGcpd:C16987
ZINC2386261
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Memory Disorders23973442CTD
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