Kopsijasmine; N-De(methoxycarbonyl)
AlkaPlorer ID: AK303691
Synonym: Kopsijasminine, Δ16,17-Kopsinine, 16,17-Didehydrokopsinine
IUPAC Name: methyl 2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3,5,7,17-tetraene-18-carboxylate
Structure
SMILES: COC(=O)C1=CC23CCCN4CCC5(C6=CC=CC=C6NC15CC2)C43
InChI: InChI=1S/C21H24N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,13,18,22H,4,7-12H2,1H3
InChIKey: TWIOZZYFVQAUFH-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 336.4350000000001
TPSA？: 41.57
MolLogP？: 2.8500000000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|