(-)-12-Methoxykopsinaline
AlkaPlorer ID: AK200469
Synonym: 'Kopsinine T'
IUPAC Name: methyl (1S,9R,16R,18R,21S)-18-hydroxy-4-methoxy-2,12-diazahexacyclo[14.2.2.19,12.01,9.03,8.016,21]henicosa-3(8),4,6-triene-18-carboxylate
Structure
SMILES: COC(=O)[C@@]1(O)C[C@@]23CCCN4CC[C@@]5(C6=CC=CC(OC)=C6N[C@]15CC2)[C@@H]43
InChI: InChI=1S/C22H28N2O4/c1-27-15-6-3-5-14-16(15)23-22-9-8-19(13-21(22,26)18(25)28-2)7-4-11-24-12-10-20(14,22)17(19)24/h3,5-6,17,23,26H,4,7-13H2,1-2H3/t17-,19+,20+,21-,22-/m0/s1
InChIKey: ADIZHYKMXNXYPA-SSXICUSMSA-N
Reference
Alcaloïdes Indoliques Monomères de<i>Kopsia officinalis</i>
PubChem CID: 162937692
LOTUS: LTS0074679
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia officinalis | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 384.4760000000001
TPSA？: 71.03
MolLogP？: 2.0533999999999994
Number of H-Donors: 2
Number of H-Acceptors: 6
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|