7-Methoxyheptaphylline
AlkaPlorer ID: AK038993
Synonym: '2-Hydroxy-7-methoxy-1-(3-methyl-2-buten-1-yl)-9H-carbazole-3-carbaldehyde'
IUPAC Name: 2-hydroxy-7-methoxy-1-(3-methylbut-2-enyl)-9H-carbazole-3-carbaldehyde
Structure
SMILES: COC1=CC=C2C(=C1)NC1=C(CC=C(C)C)C(O)=C(C=O)C=C12
InChI: InChI=1S/C19H19NO3/c1-11(2)4-6-15-18-16(8-12(10-21)19(15)22)14-7-5-13(23-3)9-17(14)20-18/h4-5,7-10,20,22H,6H2,1-3H3
InChIKey: RJWKVZMWLOWCMX-UHFFFAOYSA-N
Reference
Three New Carbazole Alkaloids Isolated from Murraya siamensis
PubChem CID: 189688
CAS: 119736-84-4
LOTUS: LTS0241564
COCONUT: CNP0308467
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Murraya koenigii | Murraya | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 309.365
TPSA？: 62.32
MolLogP？: 4.356500000000004
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia | Artemia | LC50 | 500.0 | ppm | 10.1021/np50060a044 |
| Chlorocebus sabaeus | Vero | Activity | nan | None | 10.1016/j.ejmech.2011.05.041 |
| Chlorocebus sabaeus | Vero | IC50 | 200000.0 | nM | 10.1021/np100654m |
| Chlorocebus sabaeus | Vero | IC50 | nan | None | 10.1016/j.bmc.2016.12.038 |
| Escherichia coli | Escherichia coli | MIC | 128.0 | ug.mL-1 | 10.1021/np3000365 |
| Homo sapiens | A549 | ED50 | 2.16 | ug ml-1 | 10.1021/np50060a044 |
| Homo sapiens | Butyrylcholinesterase | IC50 | 100000.0 | nM | 10.1016/j.ejmech.2014.01.020 |
| Homo sapiens | HT-29 | ED50 | 1.36 | ug ml-1 | 10.1021/np50060a044 |
| Homo sapiens | KB | IC50 | 2750.0 | nM | 10.1016/j.ejmech.2011.05.041 |
| Homo sapiens | KB | IC50 | 2750.0 | nM | 10.1021/np100654m |
| Homo sapiens | KB | IC50 | nan | None | 10.1021/np3000365 |
| Homo sapiens | MCF7 | IC50 | 53900.0 | nM | 10.1021/np3000365 |
| Homo sapiens | NCI-H187 | IC50 | 1680.0 | nM | 10.1016/j.ejmech.2011.05.041 |
| Homo sapiens | NCI-H187 | IC50 | 1680.0 | nM | 10.1021/np100654m |
| Homo sapiens | NCI-H187 | IC50 | 42300.0 | nM | 10.1021/np3000365 |
| Murinae | NG108-15 | Activity | 65.53 | % | 10.1016/j.ejmech.2014.01.020 |
| Mycobacterium tuberculosis | Mycobacterium tuberculosis | MIC90 | 20600.0 | nM | 10.1016/j.bmc.2016.12.038 |
| Rattus norvegicus | C6 | Activity | nan | None | 10.1016/j.ejmech.2014.01.020 |
| Salmonella enterica subsp. enterica serovar Typhimurium | Salmonella typhimurium | MIC | 128.0 | ug.mL-1 | 10.1021/np3000365 |
| Staphylococcus aureus | Staphylococcus aureus | MIC | nan | None | 10.1021/np3000365 |
| None | NON-PROTEIN TARGET | ED50 | 2.87 | ug ml-1 | 10.1021/np50060a044 |
| None | NON-PROTEIN TARGET | ED50 | 3.01 | ug ml-1 | 10.1021/np50060a044 |
| None | NON-PROTEIN TARGET | ED50 | 10.0 | ug ml-1 | 10.1021/np50060a044 |
| None | NON-PROTEIN TARGET | IC50 | 10780.0 | nM | 10.1016/j.ejmech.2014.01.020 |
| None | Unchecked | IC50 | 100000.0 | nM | 10.1016/j.ejmech.2014.01.020 |