Setoclavine; (+)-form, 18-Hydroxy
AlkaPlorer ID: AK313463
Synonym: Penniclavine
IUPAC Name: 9-(hydroxymethyl)-7-methyl-4,6,6a,8-tetrahydroindolo[4,3-fg]quinolin-9-ol
Structure
SMILES: CN1CC(O)(CO)C=C2C3=C4C(=CNC4=CC=C3)CC21
InChI: InChI=1S/C16H18N2O2/c1-18-8-16(20,9-19)6-12-11-3-2-4-13-15(11)10(7-17-13)5-14(12)18/h2-4,6-7,14,17,19-20H,5,8-9H2,1H3
InChIKey: KCHBNRCSCHMJFD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Argyreia | Convolvulaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 270.332
TPSA？: 59.49
MolLogP？: 1.1448
Number of H-Donors: 3
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|