Aristolasicone
AlkaPlorer ID: AK224932
Synonym: None
IUPAC Name: 1,14,14-trimethyl-9,13-diazapentacyclo[13.2.2.02,10.03,8.012,17]nonadeca-2(10),3,5,7-tetraen-19-one
Structure
SMILES: CC1(C)NC2CC3=C(C4=CC=CC=C4N3)C3(C)CC(=O)C1CC23
InChI: InChI=1S/C20H24N2O/c1-19(2)13-8-12-15(22-19)9-16-18(20(12,3)10-17(13)23)11-6-4-5-7-14(11)21-16/h4-7,12-13,15,21-22H,8-10H2,1-3H3
InChIKey: ILRQFUPHFHVNBI-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aristotelia australasica | Aristotelia | Elaeocarpaceae | Oxalidales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 308.42500000000007
TPSA？: 44.89
MolLogP？: 3.3274000000000017
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|