Clausine F
AlkaPlorer ID: AK028352
Synonym: None
IUPAC Name: methyl 1-hydroxy-4-(3-methylbut-2-enyl)-9H-carbazole-3-carboxylate
Structure
SMILES: COC(=O)C1=CC(O)=C2NC3=CC=CC=C3C2=C1CC=C(C)C
InChI: InChI=1S/C19H19NO3/c1-11(2)8-9-12-14(19(22)23-3)10-16(21)18-17(12)13-6-4-5-7-15(13)20-18/h4-8,10,20-21H,9H2,1-3H3
InChIKey: PAQIMQDRJHTGBI-UHFFFAOYSA-N
Reference
γ-Lactone Carbazoles from <i>Clausena anisata</i>
PubChem CID: 132514
CAS: 142846-96-6
LOTUS: LTS0018033
COCONUT: CNP0363551
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Clausena excavata | Clausena | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 309.36500000000007
TPSA？: 62.32
MolLogP？: 4.322000000000003
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HL-60 | Activity | nan | None | 10.1021/np800735m |
| Homo sapiens | Raji | Activity | 60.0 | % | 10.1021/np990285x |
| Homo sapiens | Raji | Activity | 80.0 | % | 10.1021/np990285x |
| None | Unchecked | Activity | 20.2 | % | 10.1021/np990285x |
| None | Unchecked | Activity | 37.5 | % | 10.1021/np990285x |
| None | Unchecked | Activity | 69.8 | % | 10.1021/np990285x |
| None | Unchecked | Activity | 94.6 | % | 10.1021/np990285x |