Diaboline
AlkaPlorer ID: AK006382
Synonym: '', 'Diaboline'
IUPAC Name: 1-[(4R,12R,13S,14S,19R,21S)-14-hydroxy-15-oxa-1,11-diazahexacyclo[16.3.1.04,12.04,21.05,10.013,19]docosa-5,7,9,17-tetraen-11-yl]ethanone
Structure
SMILES: CC(=O)N1C2=CC=CC=C2[C@]23CCN4CC5=CCO[C@H](O)[C@@H]([C@H]5C[C@H]42)[C@@H]13
InChI: InChI=1S/C21H24N2O3/c1-12(24)23-16-5-3-2-4-15(16)21-7-8-22-11-13-6-9-26-20(25)18(19(21)23)14(13)10-17(21)22/h2-6,14,17-20,25H,7-11H2,1H3/t14-,17-,18-,19+,20-,21+/m0/s1
InChIKey: QSDMAJZSSDNJPO-FYWOQVLRSA-N
Reference
Alkaloids from roots of Strychnos potatorum
PubChem CID: 163059967
LOTUS: LTS0144733
SuperNatural Ⅲ: SN0313729-03
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Strychnos potatorum | Strychnos | Loganiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 352.434
TPSA？: 53.010000000000005
MolLogP？: 1.6585
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|