Yohimbine; Me ether
AlkaPlorer ID: AK221049
Synonym: 17-O-Methylyohimbine
IUPAC Name: methyl 18-methoxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate
Structure
SMILES: COC(=O)C1C(OC)CCC2CN3CCC4=C(NC5=CC=CC=C45)C3CC21
InChI: InChI=1S/C22H28N2O3/c1-26-19-8-7-13-12-24-10-9-15-14-5-3-4-6-17(14)23-21(15)18(24)11-16(13)20(19)22(25)27-2/h3-6,13,16,18-20,23H,7-12H2,1-2H3
InChIKey: OSHUAWJIVOSKAB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Amsonia elliptica | Amsonia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 368.477
TPSA？: 54.56
MolLogP？: 3.301200000000001
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|