PCIDB

KNApSAcK Metabolite C00004972

Metabolite

KNApSAcK Entry

id C00004972
Name Isorhamnetin 3,7,4'-tri-O-sulfate
CAS RN 79175-00-1
Standard InChI InChI=1S/C16H12O16S3/c1-28-11-4-7(2-3-10(11)31-34(22,23)24)15-16(32-35(25,26)27)14(18)13-9(17)5-8(6-12(13)29-15)30-33(19,20)21/h2-6,17H,1H3,(H,19,20,21)(H,22,23,24)(H,25,26,27)
Standard InChI (Main Layer) InChI=1S/C16H12O16S3/c1-28-11-4-7(2-3-10(11)31-34(22,23)24)15-16(32-35(25,26)27)14(18)13-9(17)5-8(6-12(13)29-15)30-33(19,20)21/h2-6,17H,1H3,(H,19,20,21)(H,22,23,24)(H,25,26,27)

Cluster

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

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

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CTD

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