PCIDB

KNApSAcK Metabolite C00019796

Metabolite

KNApSAcK Entry

id C00019796
Name Bergaptol-O-beta-D-glucopyranoside
CAS RN 131623-13-7
Standard InChI InChI=1S/C17H16O9/c18-6-11-13(20)14(21)15(22)17(25-11)26-16-7-1-2-12(19)24-10(7)5-9-8(16)3-4-23-9/h1-5,11,13-15,17-18,20-22H,6H2/t11?,13-,14+,15?,17+/m1/s1
Standard InChI (Main Layer) InChI=1S/C17H16O9/c18-6-11-13(20)14(21)15(22)17(25-11)26-16-7-1-2-12(19)24-10(7)5-9-8(16)3-4-23-9/h1-5,11,13-15,17-18,20-22H,6H2

Cluster

Phytochemical cluster No. 25
KCF-S cluster No. 491

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN C067416