KNApSAcK Metabolite C00005054
Metabolite
KNApSAcK Entry
| id | C00005054 |
|---|---|
| Name | Melisimplexin / 3,5,6,7-Tetramethoxy-3',4'-methylenedioxyflavone / 2-(1,3-Benzodioxol-5-yl)-3,5,6,7-tetramethoxy-4H-1-benzopyran-4-one |
| CAS RN | 479-77-6 |
| Standard InChI | InChI=1S/C20H18O8/c1-22-14-8-13-15(19(24-3)18(14)23-2)16(21)20(25-4)17(28-13)10-5-6-11-12(7-10)27-9-26-11/h5-8H,9H2,1-4H3 |
| Standard InChI (Main Layer) | InChI=1S/C20H18O8/c1-22-14-8-13-15(19(24-3)18(14)23-2)16(21)20(25-4)17(28-13)10-5-6-11-12(7-10)27-9-26-11/h5-8H,9H2,1-4H3 |
Cluster
| Phytochemical cluster | No. 15 |
|---|---|
| KCF-S cluster | No. 27 |
Link
ChEMBL
| By standard InChI | CHEMBL1969511 |
|---|---|
| By standard InChI Main Layer | CHEMBL1969511 |
KEGG
| By LinkDB |
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CTD
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