Aristolarine
AlkaPlorer ID: AK289271
Synonym: None
IUPAC Name: 7'-(hydroxymethyl)-2',2'-dimethylspiro[1H-indole-2,6'-3-azatricyclo[5.2.2.04,8]undecane]-3-one
Structure
SMILES: CC1(C)NC2CC3(NC4=CC=CC=C4C3=O)C3(CO)CCC1CC23
InChI: InChI=1S/C20H26N2O2/c1-18(2)12-7-8-19(11-23)14(9-12)16(21-18)10-20(19)17(24)13-5-3-4-6-15(13)22-20/h3-6,12,14,16,21-23H,7-11H2,1-2H3
InChIKey: LZRWEXWVUMAXMC-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aristotelia peduncularis | Aristotelia | Elaeocarpaceae | Oxalidales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 326.4400000000001
TPSA？: 61.36
MolLogP？: 2.582700000000001
Number of H-Donors: 3
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|