PCIDB

KNApSAcK Metabolite C00031127

Metabolite

KNApSAcK Entry

id C00031127
Name RA IX
CAS RN 140679-93-2
Standard InChI InChI=1S/C43H50N6O10/c1-24-40(53)48(5)34-21-27-10-15-30(16-11-27)59-36-23-28(12-18-35(36)58-7)22-33(47(4)43(34)56)39(52)45-25(2)41(54)49-31(17-19-37(49)50)42(55)46(3)32(38(51)44-24)20-26-8-13-29(57-6)14-9-26/h8-16,18,23-25,31-34H,17,19-22H2,1-7H3,(H,44,51)(H,45,52)
Standard InChI (Main Layer) InChI=1S/C43H50N6O10/c1-24-40(53)48(5)34-21-27-10-15-30(16-11-27)59-36-23-28(12-18-35(36)58-7)22-33(47(4)43(34)56)39(52)45-25(2)41(54)49-31(17-19-37(49)50)42(55)46(3)32(38(51)44-24)20-26-8-13-29(57-6)14-9-26/h8-16,18,23-25,31-34H,17,19-22H2,1-7H3,(H,44,51)(H,45,52)

Cluster

Phytochemical cluster
KCF-S cluster No. 497

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL562775

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Rubiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Rubia akane 25473 Rubiaceae asterids Viridiplantae