PCIDB

KNApSAcK Metabolite C00008642

Metabolite

KNApSAcK Entry

id C00008642
Name Isotirumalin
CAS RN 119736-72-0
Standard InChI InChI=1S/C22H24O7/c1-11(2)5-7-13-16(28-4)10-17-18(19(13)24)20(25)21(26)22(29-17)12-6-8-15(27-3)14(23)9-12/h5-6,8-10,21-24,26H,7H2,1-4H3/t21-,22+/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H24O7/c1-11(2)5-7-13-16(28-4)10-17-18(19(13)24)20(25)21(26)22(29-17)12-6-8-15(27-3)14(23)9-12/h5-6,8-10,21-24,26H,7H2,1-4H3

Cluster

Phytochemical cluster No. 14
KCF-S cluster No. 276

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Fabaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Rhynchosia cyanosperma 132460 Fabaceae rosids Viridiplantae