Melovinone
AlkaPlorer ID: AK105075
Synonym: ''
IUPAC Name: 3,7,8-trimethoxy-2-methyl-5-(5-phenylpentyl)-1H-quinolin-4-one
Structure
SMILES: COC1=CC(CCCCCC2=CC=CC=C2)=C2C(=O)C(OC)=C(C)NC2=C1OC
InChI: InChI=1S/C24H29NO4/c1-16-23(28-3)22(26)20-18(15-19(27-2)24(29-4)21(20)25-16)14-10-6-9-13-17-11-7-5-8-12-17/h5,7-8,11-12,15H,6,9-10,13-14H2,1-4H3,(H,25,26)
InChIKey: SGRGGZWBZAQRQD-UHFFFAOYSA-N
Reference
Melovinone, an open chain analogue of melochinone from Melochia tomentosa
PubChem CID: 21763831
CAS: 69905-17-5
LOTUS: LTS0035898
COCONUT: CNP0210604
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Melochia tomentosa | Melochia | Malvaceae | Malvales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 395.4990000000002
TPSA？: 60.55
MolLogP？: 4.817820000000004
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Rattus norvegicus | L6 | IC50 | 23000.0 | nM | 10.1021/acs.jnatprod.0c00671 |
| Trypanosoma cruzi | Trypanosoma cruzi | IC50 | 12900.0 | nM | 10.1021/acs.jnatprod.0c00671 |
| None | Unchecked | Ratio IC50 | 1.5 | None | 10.1021/acs.jnatprod.0c00671 |