PCIDB

KNApSAcK Metabolite C00026769

Metabolite

KNApSAcK Entry

id C00026769
Name Neonaucleoside C / (-)-Neonaucleoside C
CAS RN 539825-82-6
Standard InChI InChI=1S/C44H54N2O20/c1-4-16-19(21(39(57)59-3)14-60-41(16)65-43-36(53)34(51)32(49)26(12-47)63-43)10-24-30-28(18-8-6-7-9-23(18)45-30)29(31(46-24)38(55)56)25-11-20-17(5-2)42(61-15-22(20)40(58)62-25)66-44-37(54)35(52)33(50)27(13-48)64-44/h4-9,14-17,19-20,24-27,29,31-37,41-54H,1-2,10-13H2,3H3,(H,55,56)/t16-,17-,19+,20?,24+,25-,26?,27?,29-,31?,32-,33-,34?,35?,36+,37+,41+,42+,43+,44+/m1/s1
Standard InChI (Main Layer) InChI=1S/C44H54N2O20/c1-4-16-19(21(39(57)59-3)14-60-41(16)65-43-36(53)34(51)32(49)26(12-47)63-43)10-24-30-28(18-8-6-7-9-23(18)45-30)29(31(46-24)38(55)56)25-11-20-17(5-2)42(61-15-22(20)40(58)62-25)66-44-37(54)35(52)33(50)27(13-48)64-44/h4-9,14-17,19-20,24-27,29,31-37,41-54H,1-2,10-13H2,3H3,(H,55,56)

Cluster

Phytochemical cluster
KCF-S cluster No. 2245

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
Neonauclea sessilifolia 165066 Rubiaceae asterids Viridiplantae