PCIDB

KNApSAcK Metabolite C00014482

Metabolite

KNApSAcK Entry

id C00014482
Name Isogemichalcone C / 3'-(4-Feruloyloxy-3-methylbutyl-2(E)-enyl)-2,4,2',4'-tetrahydroxychalcone
CAS RN 376590-14-6
Standard InChI InChI=1S/C30H28O9/c1-18(17-39-29(36)14-5-19-4-11-26(34)28(15-19)38-2)3-9-22-25(33)13-10-23(30(22)37)24(32)12-7-20-6-8-21(31)16-27(20)35/h3-8,10-16,31,33-35,37H,9,17H2,1-2H3/b12-7+,14-5+,18-3+
Standard InChI (Main Layer) InChI=1S/C30H28O9/c1-18(17-39-29(36)14-5-19-4-11-26(34)28(15-19)38-2)3-9-22-25(33)13-10-23(30(22)37)24(32)12-7-20-6-8-21(31)16-27(20)35/h3-8,10-16,31,33-35,37H,9,17H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1706

Link

ChEMBL

By standard InChI CHEMBL463638
By standard InChI Main Layer CHEMBL463638 CHEMBL499860

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Moraceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Broussonetia papyrifera 172644 Moraceae rosids Viridiplantae

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P11511 Cytochrome P450 19A1 Cytochrome P450 19A1 CHEMBL463638 CHEMBL949646 (1)
2 / 2

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (2)

OMIM preferred title UniProt
#613546 Aromatase deficiency P11511
#139300 Aromatase excess syndrome; aexs P11511

KEGG DISEASE (2)

KEGG disease name UniProt
H00599 46,XX disorders of sex development (Disorders related to androgen excess) P11511 (related)
H00794 Aromatase excess syndrome P11511 (related)