PCIDB

KNApSAcK Metabolite C00033930

Metabolite

KNApSAcK Entry

id C00033930
Name Hydrocosisaponin E / (-)-Hydrocosisaponin E
CAS RN 1033425-39-6
Standard InChI InChI=1S/C55H90O25/c1-22(59)74-45-44(71)55(21-58)24(15-50(45,2)3)23-9-10-30-52(6)13-12-32(51(4,5)29(52)11-14-53(30,7)54(23,8)16-31(55)61)78-49-43(80-48-40(69)37(66)35(64)27(18-57)76-48)41(70)42(79-47-39(68)36(65)34(63)26(17-56)75-47)28(77-49)20-73-46-38(67)33(62)25(60)19-72-46/h9,24-49,56-58,60-71H,10-21H2,1-8H3/t24?,25-,26+,27+,28+,29-,30+,31+,32-,33-,34+,35+,36-,37-,38+,39+,40+,41-,42+,43+,44-,45-,46?,47-,48-,49-,52-,53+,54+,55-/m0/s1
Standard InChI (Main Layer) InChI=1S/C55H90O25/c1-22(59)74-45-44(71)55(21-58)24(15-50(45,2)3)23-9-10-30-52(6)13-12-32(51(4,5)29(52)11-14-53(30,7)54(23,8)16-31(55)61)78-49-43(80-48-40(69)37(66)35(64)27(18-57)76-48)41(70)42(79-47-39(68)36(65)34(63)26(17-56)75-47)28(77-49)20-73-46-38(67)33(62)25(60)19-72-46/h9,24-49,56-58,60-71H,10-21H2,1-8H3

Cluster

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

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Araliaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Hydrocotyle sibthorpioides 4049 Araliaceae asterids Viridiplantae