PCIDB

KNApSAcK Metabolite C00010123

Metabolite

KNApSAcK Entry

id C00010123
Name 3'-O-Methylorobol 7-O-glucoside
CAS RN 36190-96-2
Standard InChI InChI=1S/C22H22O11/c1-30-14-4-9(2-3-12(14)24)11-8-31-15-6-10(5-13(25)17(15)18(11)26)32-22-21(29)20(28)19(27)16(7-23)33-22/h2-6,8,16,19-25,27-29H,7H2,1H3/t16?,19-,20+,21?,22-/m1/s1
Standard InChI (Main Layer) InChI=1S/C22H22O11/c1-30-14-4-9(2-3-12(14)24)11-8-31-15-6-10(5-13(25)17(15)18(11)26)32-22-21(29)20(28)19(27)16(7-23)33-22/h2-6,8,16,19-25,27-29H,7H2,1H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 2

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN