MetaADEDB 2.0 @ LMMD
3-N-butyl-4,5-dihydrophthalide
(ZPIKVDODKLJKIN-UHFFFAOYSA-N)
Structure
SMILES
CCCCC1OC(=O)C2=C1CCC=C2
Molecular Formula:
C12H16O2
Molecular Weight:
192.254
Log P:
2.7486
Hydrogen Bond Acceptor:
2
Hydrogen Bond Donor:
0
TPSA:
26.3
CAS Number(s):
62006-39-7; 166733-97-7
Synonym(s)
1.
3-N-butyl-4,5-dihydrophthalide
2.
3-N-butyl-4,5-dihydrophthalide, (S)-isomer
3.
NBPA
4.
sedanenolide
5.
senkyunolide
6.
senkyunolide A
External Link(s)
MeSHC045855
PubChem Compound173843
CHEMBLCHEMBL2288883
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Migraine Disorders21235591CTD
2Pain21235591CTD
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