PCIDB

KNApSAcK Metabolite C00019668

Metabolite

KNApSAcK Entry

id C00019668
Name 4'-Demethyltoxicarol / 5,4'-Dihydroxy-2',5'-dimethoxy-6'',6''-dimethylpyrano[2'',3'':7,8]isoflavone
CAS RN 90486-63-8
Standard InChI InChI=1S/C22H20O7/c1-22(2)6-5-11-17(29-22)9-15(24)19-20(25)13(10-28-21(11)19)12-7-18(27-4)14(23)8-16(12)26-3/h5-10,23-24H,1-4H3
Standard InChI (Main Layer) InChI=1S/C22H20O7/c1-22(2)6-5-11-17(29-22)9-15(24)19-20(25)13(10-28-21(11)19)12-7-18(27-4)14(23)8-16(12)26-3/h5-10,23-24H,1-4H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 24

Link

ChEMBL

By standard InChI CHEMBL250439
By standard InChI Main Layer CHEMBL250439

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 2

Family

family name count
Fabaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Millettia brandisiana 53625 Fabaceae rosids Viridiplantae
Tephrosia polyphylla 3803 Fabaceae rosids Viridiplantae