PCIDB

KNApSAcK Metabolite C00044221

Metabolite

KNApSAcK Entry

id C00044221
Name Ligurobustoside J / (-)-Ligurobustoside J
CAS RN 189276-61-7
Standard InChI InChI=1S/C37H54O16/c1-18(2)7-6-8-19(3)15-16-47-35-31(46)34(33(24(17-38)50-35)51-25(40)14-11-22-9-12-23(39)13-10-22)53-37-30(45)28(43)32(21(5)49-37)52-36-29(44)27(42)26(41)20(4)48-36/h7,9-15,20-21,24,26-39,41-46H,6,8,16-17H2,1-5H3/b14-11+,19-15+/t20-,21-,24+,26-,27+,28-,29+,30+,31+,32-,33+,34+,35+,36-,37-/m0/s1
Standard InChI (Main Layer) InChI=1S/C37H54O16/c1-18(2)7-6-8-19(3)15-16-47-35-31(46)34(33(24(17-38)50-35)51-25(40)14-11-22-9-12-23(39)13-10-22)53-37-30(45)28(43)32(21(5)49-37)52-36-29(44)27(42)26(41)20(4)48-36/h7,9-15,20-21,24,26-39,41-46H,6,8,16-17H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 458

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
Oleaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ligustrum robustum 1028359 Oleaceae asterids Viridiplantae