Aristoteline; (+)-form, 13-Oxo, 15,16-didehydro
AlkaPlorer ID: AK263093
Synonym: Peduncularistine
IUPAC Name: 1,14,14-trimethyl-3,13-diazapentacyclo[13.2.2.02,10.04,9.012,17]nonadeca-2(10),4,6,8,18-pentaen-16-one
Structure
SMILES: CC1(C)NC2CC3=C(NC4=CC=CC=C34)C3(C)C=CC1C(=O)C23
InChI: InChI=1S/C20H22N2O/c1-19(2)13-8-9-20(3)16(17(13)23)15(22-19)10-12-11-6-4-5-7-14(11)21-18(12)20/h4-9,13,15-16,21-22H,10H2,1-3H3
InChIKey: OEHQRTJIHGTBEA-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aristotelia peduncularis | Aristotelia | Elaeocarpaceae | Oxalidales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 306.40900000000005
TPSA？: 44.89
MolLogP？: 3.103400000000001
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|