Dehydrocavidine
AlkaPlorer ID: AK004330
Synonym: None
IUPAC Name: 16,17-dimethoxy-12-methyl-5,7-dioxa-1-azoniapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaene;chloride
Structure
SMILES: CC1=C2C=CC3=C(C2=C[N+]4=C1C5=CC(=C(C=C5CC4)OC)OC)OCO3.[Cl-]
InChI: InChI=1S/C21H20NO4.ClH/c1-12-14-4-5-17-21(26-11-25-17)16(14)10-22-7-6-13-8-18(23-2)19(24-3)9-15(13)20(12)22;/h4-5,8-10H,6-7,11H2,1-3H3;1H/q+1;/p-1
InChIKey: YSJCIJQVDSPGTM-UHFFFAOYSA-M
Reference
Alkaloids from Corydalis saxicola and Their Anti‐Hepatitis B Virus Activity
PubChem CID: 44559283
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Corydalis tomentella | Corydalis | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 385.8470000000001
TPSA？: 40.8
MolLogP？: 0.40871999999999975
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Cavia porcellus | Ileum | Activity | 20.0 | % | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | Activity | 40.0 | % | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | Activity | nan | None | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | IC50 | 0.5 | ug.mL-1 | 10.1021/np50027a004 |
| Cavia porcellus | Ileum | IC50 | 0.5 | ug.mL-1 | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | Inhibition | 20.0 | % | 10.1021/np50027a004 |
| Cavia porcellus | Ileum | Inhibition | 40.0 | % | 10.1021/np50027a004 |