PCIDB

KNApSAcK Metabolite C00004970

Metabolite

KNApSAcK Entry

id C00004970
Name Isorhamnetin 3,7-di-O-sulfate
CAS RN 79174-97-3
Standard InChI InChI=1S/C16H12O13S2/c1-26-11-4-7(2-3-9(11)17)15-16(29-31(23,24)25)14(19)13-10(18)5-8(6-12(13)27-15)28-30(20,21)22/h2-6,17-18H,1H3,(H,20,21,22)(H,23,24,25)
Standard InChI (Main Layer) InChI=1S/C16H12O13S2/c1-26-11-4-7(2-3-9(11)17)15-16(29-31(23,24)25)14(19)13-10(18)5-8(6-12(13)27-15)28-30(20,21)22/h2-6,17-18H,1H3,(H,20,21,22)(H,23,24,25)

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 51

Link

ChEMBL

By standard InChI CHEMBL1207958
By standard InChI Main Layer CHEMBL1207958

KEGG

By LinkDB

CTD

By CAS RN