7-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one
AlkaPlorer ID: AK114746
Synonym: None
IUPAC Name: 7-methoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one
Structure
SMILES: COC1=CC2=C3C(=N1)C=CC(=O)N3C1=CC=CC=C21
InChI: InChI=1S/C15H10N2O2/c1-19-13-8-10-9-4-2-3-5-12(9)17-14(18)7-6-11(16-13)15(10)17/h2-8H,1H3
InChIKey: CDWAXMGQLZGHDU-UHFFFAOYSA-N
Reference
Antifertility activity of Quassia amara in male rats — In vivo study
PubChem CID: 10106139
LOTUS: LTS0094552
SuperNatural Ⅲ: SN0043060
COCONUT: CNP0173021
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Quassia amara | Quassia | Simaroubaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 250.257
TPSA？: 43.6
MolLogP？: 2.4473000000000003
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Col2 | IC50 | 503.0 | nM | 10.1016/j.ejmech.2021.113688 |
| Homo sapiens | HUVEC | IC50 | 503.0 | nM | 10.1016/j.ejmech.2021.113688 |
| Homo sapiens | LNCaP | IC50 | 503.0 | nM | 10.1016/j.ejmech.2021.113688 |
| Homo sapiens | TERT-RPE1 | IC50 | 503.0 | nM | 10.1016/j.ejmech.2021.113688 |
| None | Unchecked | IC50 | 503.0 | nM | 10.1016/j.ejmech.2021.113688 |