Litebamine
AlkaPlorer ID: AK039087
Synonym: 1,2,3,4-Tetrahydro-9,11-dimethoxy-2-methylnaphth[2,1-f]isoquinoline-8,12-diol
IUPAC Name: 9,11-dimethoxy-2-methyl-3,4-dihydro-1H-naphtho[2,1-f]isoquinoline-8,12-diol
Structure
SMILES: COC1=C(O)C=C2C=CC3=C(C(OC)=C(O)C4=C3CCN(C)C4)C2=C1
InChI: InChI=1S/C20H21NO4/c1-21-7-6-12-13-5-4-11-8-16(22)17(24-2)9-14(11)18(13)20(25-3)19(23)15(12)10-21/h4-5,8-9,22-23H,6-7,10H2,1-3H3
InChIKey: QOWFEPGZJDCIKG-UHFFFAOYSA-N
Reference
Litebamine, a novel phenanthrene alkaloid from Litsea cubeba
PubChem CID: 196885
CAS: 137031-56-2
LOTUS: LTS0142332
SuperNatural Ⅲ: SN0311247
NPASS: NPC60186
COCONUT: CNP0299767
Source
Properties Information
Molecule Weight: 339.3910000000001
TPSA？: 62.16
MolLogP？: 3.4093000000000018
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Electrophorus electricus | Acetylcholinesterase | IC50 | 22000.0 | nM | 10.1021/np970298f |
| None | NON-PROTEIN TARGET | Inhibition | 77.0 | % | 10.1021/np970298f |