Benzosimuline
AlkaPlorer ID: AK005591
Synonym: ''
IUPAC Name: 6,6,9,12-tetramethylisochromeno[4,3-c]quinolin-11-one
Structure
SMILES: CC1=CC=C2C(=C1)C1=C(OC2(C)C)C2=CC=CC=C2N(C)C1=O
InChI: InChI=1S/C20H19NO2/c1-12-9-10-15-14(11-12)17-18(23-20(15,2)3)13-7-5-6-8-16(13)21(4)19(17)22/h5-11H,1-4H3
InChIKey: OSBHLKXCNYMURI-UHFFFAOYSA-N
Reference
Pyranoquinoline alkaloids from Zanthoxylum simulans
PubChem CID: 5321951
CAS: 198336-58-2
LOTUS: LTS0126484
SuperNatural Ⅲ: SN0273763
COCONUT: CNP0337717
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zanthoxylum simulans | Zanthoxylum | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 305.37700000000007
TPSA？: 31.23
MolLogP？: 4.141420000000004
Number of H-Donors: 0
Number of H-Acceptors: 3
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|