Diaporphasine A
AlkaPlorer ID: AK001442
Synonym: None
IUPAC Name: methyl 7-methoxy-3-methyl-10-oxochromeno[3,2-c]pyridine-9-carboxylate
Structure
SMILES: CC1=CC2=C(C=N1)C(=O)C3=C(C=C(C=C3O2)OC)C(=O)OC
InChI: InChI=1S/C16H13NO5/c1-8-4-12-11(7-17-8)15(18)14-10(16(19)21-3)5-9(20-2)6-13(14)22-12/h4-7H,1-3H3
InChIKey: LKLORZXBLHWLBI-UHFFFAOYSA-N
Reference
Alkaloids from the mangrove endophytic fungus Diaporthe phaseolorum SKS019
PubChem CID: 137647584
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Diaporthe phaseolorum | Diaporthe | Diaporthaceae | Diaporthales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 299.28200000000004
TPSA？: 78.63000000000001
MolLogP？: 2.44482
Number of H-Donors: 0
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | HCT-116 | GI | nan | None | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | HCT-116 | IC50 | 50000.0 | nM | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | HepG2 | GI | nan | None | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | HepG2 | IC50 | 50000.0 | nM | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | MCF-10A | GI | nan | None | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | MCF-10A | IC50 | 50000.0 | nM | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | MDA-MB-435 | GI | nan | None | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | MDA-MB-435 | IC50 | 50000.0 | nM | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | NCI-H460 | GI | nan | None | 10.1016/j.bmcl.2017.01.029 |
| Homo sapiens | NCI-H460 | IC50 | 50000.0 | nM | 10.1016/j.bmcl.2017.01.029 |