Murrayanine
AlkaPlorer ID: AK005500
Synonym: None
IUPAC Name: 1-methoxy-9H-carbazole-3-carbaldehyde
Structure
SMILES: COC1=CC(C=O)=CC2=C1NC1=CC=CC=C12
InChI: InChI=1S/C14H11NO2/c1-17-13-7-9(8-16)6-11-10-4-2-3-5-12(10)15-14(11)13/h2-8,15H,1H3
InChIKey: FWNZQNAJETXQPP-UHFFFAOYSA-N
Reference
Claurailas A−D, Cytotoxic Carbazole Alkaloids from the Roots of <i>Clausena harmandiana</i>
PubChem CID: 96942
CAS: 723-97-7
LOTUS: LTS0144992
COCONUT: CNP0088497
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Murraya koenigii | Murraya | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 225.247
TPSA？: 42.09
MolLogP？: 3.1422000000000008
Number of H-Donors: 1
Number of H-Acceptors: 2
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Chlorocebus sabaeus | Vero | IC50 | 200000.0 | nM | 10.1021/np100654m |
| Homo sapiens | KB | IC50 | 72230.0 | nM | 10.1021/np100654m |
| Homo sapiens | NCI-H187 | IC50 | 11450.0 | nM | 10.1021/np100654m |
| Rattus norvegicus | PC-12 | Activity | nan | None | 10.1021/np200919a |
| None | NON-PROTEIN TARGET | IC50 | 3500.0 | nM | 10.1021/np500088u |
| None | NON-PROTEIN TARGET | IC50 | 3900.0 | nM | 10.1021/np500088u |