PCIDB

KNApSAcK Metabolite C00031144

Metabolite

KNApSAcK Entry

id C00031144
Name Rediocide C
CAS RN 677277-98-4
Standard InChI InChI=1S/C46H54O13/c1-24-21-32-43(52)35(24)55-33(48)18-12-11-17-31(54-39(49)27-13-7-5-8-14-27)30-20-19-28(25(30)2)22-41(4,51)45(53)36-26(3)44(32)34(37-42(23-47,56-37)40(43)50)38(45)58-46(57-36,59-44)29-15-9-6-10-16-29/h5-18,24-26,28,30-32,34-38,40,47,50-53H,19-23H2,1-4H3/b17-11-,18-12+
Standard InChI (Main Layer) InChI=1S/C46H54O13/c1-24-21-32-43(52)35(24)55-33(48)18-12-11-17-31(54-39(49)27-13-7-5-8-14-27)30-20-19-28(25(30)2)22-41(4,51)45(53)36-26(3)44(32)34(37-42(23-47,56-37)40(43)50)38(45)58-46(57-36,59-44)29-15-9-6-10-16-29/h5-18,24-26,28,30-32,34-38,40,47,50-53H,19-23H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1439

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL506506 CHEMBL1765396 CHEMBL2093891

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Euphorbiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Trigonostemon reidioides (KURZ) 289660 Euphorbiaceae rosids Viridiplantae