Convolvine; O4'-De-Me
AlkaPlorer ID: AK292946
Synonym: Convolidine, 3α-Vanilloyloxynortropane
IUPAC Name: 8-azabicyclo[3.2.1]octan-3-yl 4-hydroxy-3-methoxybenzoate
Structure
SMILES: COC1=CC(C(=O)OC2CC3CCC(C2)N3)=CC=C1O
InChI: InChI=1S/C15H19NO4/c1-19-14-6-9(2-5-13(14)17)15(18)20-12-7-10-3-4-11(8-12)16-10/h2,5-6,10-12,16-17H,3-4,7-8H2,1H3
InChIKey: GWWGRYGNRKFSSX-UHFFFAOYSA-N
Reference
Tropane alkaloids of two species of plants of theConvolvulus genus
PubChem CID: 573663
CAS: 63911-32-0
LOTUS: LTS0185953
COCONUT: CNP0167835.2
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Convolvulus subhirsutus | Convolvulus | Convolvulaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Convolvulus | Convolvulaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Convolvulus | Convolvulaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 277.32
TPSA？: 67.79
MolLogP？: 1.8406
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|