Metabolite

KNApSAcK Entry

id C00030519
Name Isobonducellin / (Z)-7-Hydroxy-3-(4'-methoxybenzylidene)chroman-4-one
CAS RN 17627-43-9
Standard InChI InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3
Standard InChI (Main Layer) InChI=1S/C15H24O/c1-10-5-6-13-15(4,16-13)8-7-12-11(10)9-14(12,2)3/h11-13H,1,5-9H2,2-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 500

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL399036 CHEMBL508894 CHEMBL479134 CHEMBL1513806 CHEMBL1553274

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
Caesalpinia pulcherrima 53846 Fabaceae rosids Viridiplantae

Human Protein / Gene in interaction

3 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 CHEMBL1513806 CHEMBL1614027 (1)
0 / 1
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 CHEMBL1513806 CHEMBL1613777 (1)
1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL1553274 CHEMBL1614108 (1) CHEMBL1613886 (1)
0 / 1

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (1)

OMIM preferred title UniProt
#609535 Drug metabolism, poor, cyp2c19-related P33261

KEGG DISEASE (3)

KEGG disease name UniProt
H00036 Osteosarcoma P08684 (marker)
H01205 Coumarin resistance P11712 (related)
H01171 Poor drug metabolism (PM) P33261 (related)