(-)-11,12-Methylenedioxy-kopsinaline
AlkaPlorer ID: AK035029
Synonym: 'N-Decarbomethoxykopsamine', 'Kopsinine H'
IUPAC Name: methyl (1S,12R,19R,21S,24S)-21-hydroxy-5,7-dioxa-2,15-diazaheptacyclo[17.2.2.112,15.01,12.03,11.04,8.019,24]tetracosa-3(11),4(8),9-triene-21-carboxylate
Structure
SMILES: COC(=O)[C@]1(O)C[C@@]23CCCN4CC[C@@]5(C6=CC=C7OCOC7=C6N[C@]15CC2)[C@@H]43
InChI: InChI=1S/C22H26N2O5/c1-27-18(25)21(26)11-19-5-2-9-24-10-8-20(17(19)24)13-3-4-14-16(29-12-28-14)15(13)23-22(20,21)7-6-19/h3-4,17,23,26H,2,5-12H2,1H3/t17-,19+,20+,21+,22-/m0/s1
InChIKey: JVIKUDVTJCANPX-NBYDKTAJSA-N
Reference
Alcaloïdes Indoliques Monomères de<i>Kopsia officinalis</i>
PubChem CID: 137832348
LOTUS: LTS0254155
SuperNatural Ⅲ: SN0176286-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Kopsia arborea | Kopsia | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 398.4590000000002
TPSA？: 80.26
MolLogP？: 1.7734999999999994
Number of H-Donors: 2
Number of H-Acceptors: 7
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|