9-Methoxycanthin-6-one

Chemical Information
9-methoxycanthin-6-one is an indole alkaloid that is the 9-methoxy derivative of canthin-6-one. Isolated from Eurycoma longifolia and Simaba multiflora, it exhibits cytotoxic activity towards human cancer cell lines. It has a role as a metabolite, an antineoplastic agent and an antiplasmodial drug. It is an aromatic ether, an organic heterotetracyclic compound and an indole alkaloid. It is functionally related to a canthin-6-one.
| CAS Number | 74991-91-6 |
| PubChem CID | 9881423 |
| IUPAC Name | 13-methoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one |
| Molecular Formula | C15H10N2O2 |
| Molecular Weight | 250.25 |
| XLogP | 2.4 |
| Topological Polar Surface Area | 44.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 422 |
| Property | Value |
|---|---|
| Molecular Weight | 250.25 |
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 250.074227566 |
| Monoisotopic Mass | 250.074227566 |
| Topological Polar Surface Area | 44.1 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 422 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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