PCIDB

KNApSAcK Metabolite C00044109

Metabolite

KNApSAcK Entry

id C00044109
Name Berneuxia saponin C / (-)-Berneuxia saponin C
CAS RN 214359-10-1
Standard InChI InChI=1S/C54H86O24/c1-21-31(60)34(63)36(65)45(71-21)75-40-33(62)25(19-56)73-47(39(40)68)76-41-38(67)42(44(69)70)77-48(43(41)78-46-37(66)35(64)32(61)24(18-55)72-46)74-30-12-13-51(6)26(50(30,4)5)11-14-52(7)27(51)10-9-22-23-15-49(2,3)28(58)17-54(23,20-57)29(59)16-53(22,52)8/h9,21,23-27,29-43,45-48,55-57,59-68H,10-20H2,1-8H3,(H,69,70)/t21-,23-,24+,25+,26-,27+,29+,30-,31-,32+,33-,34+,35-,36+,37+,38-,39+,40-,41-,42-,43+,45-,46-,47-,48+,51-,52+,53+,54+/m0/s1
Standard InChI (Main Layer) InChI=1S/C54H86O24/c1-21-31(60)34(63)36(65)45(71-21)75-40-33(62)25(19-56)73-47(39(40)68)76-41-38(67)42(44(69)70)77-48(43(41)78-46-37(66)35(64)32(61)24(18-55)72-46)74-30-12-13-51(6)26(50(30,4)5)11-14-52(7)27(51)10-9-22-23-15-49(2,3)28(58)17-54(23,20-57)29(59)16-53(22,52)8/h9,21,23-27,29-43,45-48,55-57,59-68H,10-20H2,1-8H3,(H,69,70)

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
Diapensiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Berneuxia thibetica 171445 Diapensiaceae asterids Viridiplantae