PCIDB

KNApSAcK Metabolite C00030536

Metabolite

KNApSAcK Entry

id C00030536
Name Isomitraphylline N-oxide
CAS RN 51920-98-0
Standard InChI InChI=1S/C21H24N2O5/c1-12-14-10-23(26)8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-28-12)19(24)27-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13-,14+,18-,21-,23?/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H24N2O5/c1-12-14-10-23(26)8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-28-12)19(24)27-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)

Cluster

Phytochemical cluster
KCF-S cluster No. 154

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 2

Family

family name count
Rubiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Mitragyna hirsuta 371154 Rubiaceae asterids Viridiplantae
Uncaria tomentosa 128375 Rubiaceae asterids Viridiplantae