Kopsinine; 15β-Hydroxy
AlkaPlorer ID: AK303727
Synonym: Hydroxykopsinine I, Ld 90
IUPAC Name: methyl 15-hydroxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3,5,7-triene-18-carboxylate
Structure
SMILES: COC(=O)C1CC23CCC14NC1=CC=CC=C1C41CCN(CCC2O)C31
InChI: InChI=1S/C21H26N2O3/c1-26-17(25)14-12-19-7-8-21(14)20(13-4-2-3-5-15(13)22-21)9-11-23(18(19)20)10-6-16(19)24/h2-5,14,16,18,22,24H,6-12H2,1H3
InChIKey: RZPUAAQUCIOUBB-UHFFFAOYSA-N
Reference
Venalstonine and dioxokopsan derivatives from Kopsia fruticosa
PubChem CID: 162922005
LOTUS: LTS0099157
COCONUT: CNP0191528.4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Melodinus australis | Melodinus | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 354.45000000000016
TPSA？: 61.8
MolLogP？: 1.9007
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|