PCIDB

KNApSAcK Metabolite C00005065

Metabolite

KNApSAcK Entry

id C00005065
Name 5-Demethylmelibentin / 5-Hydroxy-3,6,7,8-tetramethoxy-3',4'-methylenedioxyflavone / 2-(1,3-Benzodioxol-5-yl)-5-hydroxy-3,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
CAS RN 5071-28-3
Standard InChI InChI=1S/C20H18O9/c1-23-17-13(21)12-14(22)18(24-2)20(26-4)19(25-3)16(12)29-15(17)9-5-6-10-11(7-9)28-8-27-10/h5-7,22H,8H2,1-4H3
Standard InChI (Main Layer) InChI=1S/C20H18O9/c1-23-17-13(21)12-14(22)18(24-2)20(26-4)19(25-3)16(12)29-15(17)9-5-6-10-11(7-9)28-8-27-10/h5-7,22H,8H2,1-4H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 8

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN