PCIDB

KNApSAcK Metabolite C00031134

Metabolite

KNApSAcK Entry

id C00031134
Name RA X
CAS RN 140679-94-3
Standard InChI InChI=1S/C43H52N6O11/c1-24-38(52)46-31(17-19-37(50)51)42(56)47(3)32(20-26-8-13-29(58-6)14-9-26)40(54)45-25(2)41(55)49(5)34-21-27-10-15-30(16-11-27)60-36-23-28(12-18-35(36)59-7)22-33(39(53)44-24)48(4)43(34)57/h8-16,18,23-25,31-34H,17,19-22H2,1-7H3,(H,44,53)(H,45,54)(H,46,52)(H,50,51)
Standard InChI (Main Layer) InChI=1S/C43H52N6O11/c1-24-38(52)46-31(17-19-37(50)51)42(56)47(3)32(20-26-8-13-29(58-6)14-9-26)40(54)45-25(2)41(55)49(5)34-21-27-10-15-30(16-11-27)60-36-23-28(12-18-35(36)59-7)22-33(39(53)44-24)48(4)43(34)57/h8-16,18,23-25,31-34H,17,19-22H2,1-7H3,(H,44,53)(H,45,54)(H,46,52)(H,50,51)

Cluster

Phytochemical cluster
KCF-S cluster No. 497

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL554360

KEGG

By LinkDB

CTD

By CAS RN C079025

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