PCIDB

KNApSAcK Metabolite C00038178

Metabolite

KNApSAcK Entry

id C00038178
Name 18-Demethylparaensidimerin C
CAS RN 953393-39-0
Standard InChI InChI=1S/C29H28N2O4/c1-28(2)23-17(21-24(34-28)15-9-5-7-11-19(15)30-26(21)32)13-29(3)14-18(23)22-25(35-29)16-10-6-8-12-20(16)31(4)27(22)33/h5-12,17-18,23H,13-14H2,1-4H3,(H,30,32)/t17-,18+,23-,29-/m1/s1
Standard InChI (Main Layer) InChI=1S/C29H28N2O4/c1-28(2)23-17(21-24(34-28)15-9-5-7-11-19(15)30-26(21)32)13-29(3)14-18(23)22-25(35-29)16-10-6-8-12-20(16)31(4)27(22)33/h5-12,17-18,23H,13-14H2,1-4H3,(H,30,32)

Cluster

Phytochemical cluster
KCF-S cluster No. 655

Link

ChEMBL

By standard InChI CHEMBL436835
By standard InChI Main Layer CHEMBL436835

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Rutaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Zanthoxylum integrifoliolum 67937 Rutaceae rosids Viridiplantae