PCIDB

KNApSAcK Metabolite C00006875

Metabolite

KNApSAcK Entry

id C00006875
Name Delphinidin 3-(2''-galloylgalactoside)
CAS RN 142609-11-8
Standard InChI InChI=1S/C28H24O16/c29-8-20-23(38)24(39)26(44-27(40)10-3-16(34)22(37)17(35)4-10)28(43-20)42-19-7-12-13(31)5-11(30)6-18(12)41-25(19)9-1-14(32)21(36)15(33)2-9/h1-7,20,23-24,26,28-29,38-39H,8H2,(H7-,30,31,32,33,34,35,36,37,40)/p+1/t20?,23-,24?,26+,28+/m0/s1
Standard InChI (Main Layer) InChI=1S/C28H24O16/c29-8-20-23(38)24(39)26(44-27(40)10-3-16(34)22(37)17(35)4-10)28(43-20)42-19-7-12-13(31)5-11(30)6-18(12)41-25(19)9-1-14(32)21(36)15(33)2-9/h1-7,20,23-24,26,28-29,38-39H,8H2,(H7-,30,31,32,33,34,35,36,37,40)

Cluster

Phytochemical cluster
KCF-S cluster No. 98

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

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CTD

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