PCIDB

KNApSAcK Metabolite C00031071

Metabolite

KNApSAcK Entry

id C00031071
Name Polygalacin D
CAS RN 66663-91-0
Standard InChI InChI=1S/C57H92O28/c1-23-40(81-44-39(71)41(28(63)19-76-44)85-57(75)48(72)55(74,21-60)22-78-57)36(68)38(70)45(79-23)82-42-33(65)27(62)18-77-47(42)84-49(73)56-13-12-50(2,3)14-25(56)24-8-9-31-51(4)15-26(61)43(83-46-37(69)35(67)34(66)29(17-58)80-46)52(5,20-59)30(51)10-11-53(31,6)54(24,7)16-32(56)64/h8,23,25-48,58-72,74-75H,9-22H2,1-7H3/t23-,25-,26-,27-,28+,29+,30+,31+,32+,33-,34+,35-,36-,37+,38+,39+,40-,41-,42+,43-,44-,45-,46-,47-,48+,51-,52-,53+,54+,55+,56+,57+/m0/s1
Standard InChI (Main Layer) InChI=1S/C57H92O28/c1-23-40(81-44-39(71)41(28(63)19-76-44)85-57(75)48(72)55(74,21-60)22-78-57)36(68)38(70)45(79-23)82-42-33(65)27(62)18-77-47(42)84-49(73)56-13-12-50(2,3)14-25(56)24-8-9-31-51(4)15-26(61)43(83-46-37(69)35(67)34(66)29(17-58)80-46)52(5,20-59)30(51)10-11-53(31,6)54(24,7)16-32(56)64/h8,23,25-48,58-72,74-75H,9-22H2,1-7H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 4

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C17441

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Campanulaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Platycodon grandiflorum 94286 Campanulaceae asterids Viridiplantae