PCIDB

KNApSAcK Metabolite C00046055

Metabolite

KNApSAcK Entry

id C00046055
Name Junceoside C
CAS RN 393085-16-0
Standard InChI InChI=1S/C64H100O31/c1-24-34(69)39(74)49(93-54-44(79)40(75)46(25(2)87-54)90-52-41(76)35(70)28(67)21-84-52)56(86-24)95-58(83)64-17-15-59(3,4)19-27(64)26-9-10-32-60(5)13-12-33(61(6,23-66)31(60)11-14-63(32,8)62(26,7)16-18-64)89-57-50(94-55-43(78)38(73)37(72)30(20-65)88-55)47(45(80)48(92-57)51(81)82)91-53-42(77)36(71)29(68)22-85-53/h9,23-25,27-50,52-57,65,67-80H,10-22H2,1-8H3,(H,81,82)/t24-,25+,27+,28-,29-,30-,31-,32-,33+,34+,35+,36+,37+,38+,39+,40+,41-,42-,43-,44-,45+,46+,47+,48+,49-,50-,52+,53+,54+,55+,56+,57-,60+,61+,62-,63-,64+/m1/s1
Standard InChI (Main Layer) InChI=1S/C64H100O31/c1-24-34(69)39(74)49(93-54-44(79)40(75)46(25(2)87-54)90-52-41(76)35(70)28(67)21-84-52)56(86-24)95-58(83)64-17-15-59(3,4)19-27(64)26-9-10-32-60(5)13-12-33(61(6,23-66)31(60)11-14-63(32,8)62(26,7)16-18-64)89-57-50(94-55-43(78)38(73)37(72)30(20-65)88-55)47(45(80)48(92-57)51(81)82)91-53-42(77)36(71)29(68)22-85-53/h9,23-25,27-50,52-57,65,67-80H,10-22H2,1-8H3,(H,81,82)

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
eudicotyledons 1

Family

family name count
Caryophyllaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Arenaria juncea 3568 Caryophyllaceae eudicotyledons Viridiplantae