None
AlkaPlorer ID: AK323183
Synonym: None
IUPAC Name: 2-methyl-8-(3,4,5-trimethoxyphenyl)-5,12,14-trioxa-2-azatetracyclo[7.7.0.03,7.011,15]hexadeca-1(16),3(7),9,11(15)-tetraen-6-one
Structure
SMILES: COC1=CC(C2C3=C(COC3=O)N(C)C3=CC4=C(C=C32)OCO4)=CC(OC)=C1OC
InChI: InChI=1S/C22H21NO7/c1-23-13-8-16-15(29-10-30-16)7-12(13)19(20-14(23)9-28-22(20)24)11-5-17(25-2)21(27-4)18(6-11)26-3/h5-8,19H,9-10H2,1-4H3
InChIKey: UNJGJEIRNYLBQQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Bridelia ferruginea | Bridelia | Phyllanthaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 411.41000000000025
TPSA？: 75.69000000000001
MolLogP？: 2.833700000000001
Number of H-Donors: 0
Number of H-Acceptors: 8
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | MCF7 | GI50 | 0.034 | ug.mL-1 | 10.1021/acs.jnatprod.5b00873 |
| Homo sapiens | NCI-H460 | GI50 | 0.032 | ug.mL-1 | 10.1021/acs.jnatprod.5b00873 |
| Mus musculus | P388 | ED50 | 0.027 | ug ml-1 | 10.1021/acs.jnatprod.5b00873 |
| None | NON-PROTEIN TARGET | GI50 | 0.026 | ug.mL-1 | 10.1021/acs.jnatprod.5b00873 |
| None | NON-PROTEIN TARGET | GI50 | 0.029 | ug.mL-1 | 10.1021/acs.jnatprod.5b00873 |
| None | NON-PROTEIN TARGET | GI50 | 0.032 | ug.mL-1 | 10.1021/acs.jnatprod.5b00873 |
| None | NON-PROTEIN TARGET | GI50 | 0.049 | ug.mL-1 | 10.1021/acs.jnatprod.5b00873 |