Pleurostyline
AlkaPlorer ID: AK310727
Synonym: 2,3,6,7,8,9,10,11-Octahydro-6-phenyl-1H-[1,5,9]triazacyclotridecino[2,1-a][2]benzazepine-4,13(5H,19bH)-dione
IUPAC Name: 7-phenyl-1,6,10-triazatricyclo[11.9.0.014,19]docosa-14,16,18,20-tetraene-9,22-dione
Structure
SMILES: O=C1C=CC2=CC=CC=C2C2CCN=C(O)CC(C3=CC=CC=C3)NCCCCN12
InChI: InChI=1S/C25H29N3O2/c29-24-18-22(20-9-2-1-3-10-20)26-15-6-7-17-28-23(14-16-27-24)21-11-5-4-8-19(21)12-13-25(28)30/h1-5,8-13,22-23,26H,6-7,14-18H2,(H,27,29)
InChIKey: DKCWAFAXQGAJSD-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Pleurostylia africana | Pleurostylia | Celastraceae | Celastrales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 403.5260000000001
TPSA？: 64.92999999999999
MolLogP？: 4.444500000000003
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|