N-Methyl-huperzine B
AlkaPlorer ID: AK043613
Synonym: ''
IUPAC Name: (1R,9R,10R)-14,16-dimethyl-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,16-trien-5-one
Structure
SMILES: CC1=C[C@H]2CC3=C(C=CC(O)=N3)[C@@]3(C1)[C@@H]2CCCN3C
InChI: InChI=1S/C17H22N2O/c1-11-8-12-9-15-14(5-6-16(20)18-15)17(10-11)13(12)4-3-7-19(17)2/h5-6,8,12-13H,3-4,7,9-10H2,1-2H3,(H,18,20)/t12-,13+,17+/m0/s1
InChIKey: JCINWKNLTDEYIA-OGHNNQOOSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Huperzia serrata | Huperzia | Lycopodiaceae | Lycopodiales | Lycopodiopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 270.376
TPSA？: 36.36000000000001
MolLogP？: 2.8466000000000014
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Acetyl-CoA acetyltransferase, mitochondrial | Inhibition | None | % | 10.1016/j.bmcl.2016.04.019 |