Gambirine; 3-Epimer, Δ1-isomer, 7R-hydroxy, 18,19-didehydro, Me ether
AlkaPlorer ID: AK299035
Synonym: 7-Hydroxy-3-isopaynantheine
IUPAC Name: methyl 2-(3-ethenyl-7a-hydroxy-8-methoxy-2,3,4,6,7,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl)-3-methoxyprop-2-enoate
Structure
SMILES: C=CC1CN2CCC3(O)C(=NC4=CC=CC(OC)=C43)C2CC1C(=COC)C(=O)OC
InChI: InChI=1S/C23H28N2O5/c1-5-14-12-25-10-9-23(27)20-17(7-6-8-19(20)29-3)24-21(23)18(25)11-15(14)16(13-28-2)22(26)30-4/h5-8,13-15,18,27H,1,9-12H2,2-4H3
InChIKey: MALGMJVUNHCIIJ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Mitragyna diversifolia | Mitragyna | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 412.4860000000002
TPSA？: 80.59000000000002
MolLogP？: 2.568600000000001
Number of H-Donors: 1
Number of H-Acceptors: 7
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|