PCIDB

KNApSAcK Metabolite C00006384

Metabolite

KNApSAcK Entry

id C00006384
Name Isomollupentin 7-O-glucoside
CAS RN 97673-60-4
Standard InChI InChI=1S/C26H28O14/c27-7-16-20(32)22(34)24(36)26(40-16)39-15-6-14-17(11(29)5-13(38-14)9-1-3-10(28)4-2-9)21(33)18(15)25-23(35)19(31)12(30)8-37-25/h1-6,12,16,19-20,22-28,30-36H,7-8H2/t12-,16?,19-,20+,22-,23?,24?,25-,26+/m0/s1
Standard InChI (Main Layer) InChI=1S/C26H28O14/c27-7-16-20(32)22(34)24(36)26(40-16)39-15-6-14-17(11(29)5-13(38-14)9-1-3-10(28)4-2-9)21(33)18(15)25-23(35)19(31)12(30)8-37-25/h1-6,12,16,19-20,22-28,30-36H,7-8H2

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 1

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN