Claurailas C
AlkaPlorer ID: AK055773
Synonym: None
IUPAC Name: methyl 3,3-dimethyl-7H-pyrano[2,3-c]carbazole-10-carboxylate
Structure
SMILES: COC(=O)C1=CC=C2NC3=CC=C4OC(C)(C)C=CC4=C3C2=C1
InChI: InChI=1S/C19H17NO3/c1-19(2)9-8-12-16(23-19)7-6-15-17(12)13-10-11(18(21)22-3)4-5-14(13)20-15/h4-10,20H,1-3H3
InChIKey: PCLJYOVKGSBXJW-UHFFFAOYSA-N
Reference
Claurailas A−D, Cytotoxic Carbazole Alkaloids from the Roots of <i>Clausena harmandiana</i>
PubChem CID: 51039827
LOTUS: LTS0043489
COCONUT: CNP0207140
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clausena harmandiana | Clausena | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 307.34900000000005
TPSA？: 51.32000000000001
MolLogP？: 4.291900000000004
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 4
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 | 200000.0 | nM | 10.1021/np100654m |
| Homo sapiens | NCI-H187 | IC50 | 200000.0 | nM | 10.1021/np100654m |