PCIDB

KNApSAcK Metabolite C00005066

Metabolite

KNApSAcK Entry

id C00005066
Name Melibentin / 3,5,6,7,8-Pentamethoxy-3',4'-methylenedioxyflavone / 2-(1,3-Benzodioxol-5-yl)-3,5,6,7,8-pentamethoxy-4H-1-benzopyran-4-one
CAS RN 5071-42-1
Standard InChI InChI=1S/C21H20O9/c1-23-16-13-14(22)18(24-2)15(10-6-7-11-12(8-10)29-9-28-11)30-17(13)20(26-4)21(27-5)19(16)25-3/h6-8H,9H2,1-5H3
Standard InChI (Main Layer) InChI=1S/C21H20O9/c1-23-16-13-14(22)18(24-2)15(10-6-7-11-12(8-10)29-9-28-11)30-17(13)20(26-4)21(27-5)19(16)25-3/h6-8H,9H2,1-5H3

Cluster

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

Link

ChEMBL

By standard InChI CHEMBL1976139
By standard InChI Main Layer CHEMBL1976139

KEGG

By LinkDB

CTD

By CAS RN