PCIDB

KNApSAcK Metabolite C00005846

Metabolite

KNApSAcK Entry

id C00005846
Name Kaempferol 3-(2''-galloylglucoside)
CAS RN 76343-90-3
Standard InChI InChI=1S/C28H24O15/c29-9-18-21(36)23(38)26(42-27(39)11-5-15(33)20(35)16(34)6-11)28(41-18)43-25-22(37)19-14(32)7-13(31)8-17(19)40-24(25)10-1-3-12(30)4-2-10/h1-8,18,21,23,26,28-36,38H,9H2/t18?,21-,23?,26-,28+/m1/s1
Standard InChI (Main Layer) InChI=1S/C28H24O15/c29-9-18-21(36)23(38)26(42-27(39)11-5-15(33)20(35)16(34)6-11)28(41-18)43-25-22(37)19-14(32)7-13(31)8-17(19)40-24(25)10-1-3-12(30)4-2-10/h1-8,18,21,23,26,28-36,38H,9H2

Cluster

Phytochemical cluster
KCF-S cluster No. 98

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL444191

KEGG

By LinkDB

CTD

By CAS RN