Hasubanonine; O4-De-Me
AlkaPlorer ID: AK300044
Synonym: 7,8-Didehydro-4-hydroxy-3,7,8-trimethoxy-17-methylhasubanan-6-one, Aknadinine, Hernandoline, 4-Demethylhasubanonine
IUPAC Name: 3-hydroxy-4,11,12-trimethoxy-17-methyl-17-azatetracyclo[8.4.3.01,10.02,7]heptadeca-2(7),3,5,11-tetraen-13-one
Structure
SMILES: COC1=C(OC)C23CCC4=CC=C(OC)C(O)=C4C2(CCN3C)CC1=O
InChI: InChI=1S/C20H25NO5/c1-21-10-9-19-11-13(22)17(25-3)18(26-4)20(19,21)8-7-12-5-6-14(24-2)16(23)15(12)19/h5-6,23H,7-11H2,1-4H3
InChIKey: XLWYWPDYNLZUJS-UHFFFAOYSA-N
Reference
1-Nitroaknadinine from Stephania sutchuenensis
PubChem CID: 281986
CAS: 24148-86-5
LOTUS: LTS0080829
COCONUT: CNP0221856.3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stephania elegans | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Stephania hernandifolia | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 359.4220000000002
TPSA？: 68.23
MolLogP？: 2.1363000000000003
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|