PCIDB

KNApSAcK Metabolite C00031126

Metabolite

KNApSAcK Entry

id C00031126
Name RA IV
CAS RN 86849-13-0
Standard InChI InChI=1S/C41H50N6O10/c1-22-36(49)43-23(2)39(52)45(4)30(19-25-9-14-28(55-7)15-10-25)37(50)44-24(3)40(53)46(5)31-20-26-11-16-29(17-12-26)57-33-21-27(13-18-32(33)56-8)35(48)34(38(51)42-22)47(6)41(31)54/h9-18,21-24,30-31,34-35,48H,19-20H2,1-8H3,(H,42,51)(H,43,49)(H,44,50)/t22-,23+,24+,30+,31+,34+,35?/m1/s1
Standard InChI (Main Layer) InChI=1S/C41H50N6O10/c1-22-36(49)43-23(2)39(52)45(4)30(19-25-9-14-28(55-7)15-10-25)37(50)44-24(3)40(53)46(5)31-20-26-11-16-29(17-12-26)57-33-21-27(13-18-32(33)56-8)35(48)34(38(51)42-22)47(6)41(31)54/h9-18,21-24,30-31,34-35,48H,19-20H2,1-8H3,(H,42,51)(H,43,49)(H,44,50)

Cluster

Phytochemical cluster
KCF-S cluster No. 497

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
Rubiaceae 1

List (1)

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