PCIDB

KNApSAcK Metabolite C00037144

Metabolite

KNApSAcK Entry

id C00037144
Name Ferutidin / Jaeschkeanadiol p-methoxybenzoate
CAS RN 53947-82-3
Standard InChI InChI=1S/C23H32O4/c1-15(2)23(25)13-12-22(4)11-10-16(3)14-19(20(22)23)27-21(24)17-6-8-18(26-5)9-7-17/h6-10,15,19-20,25H,11-14H2,1-5H3/t19-,20+,22-,23+/m0/s1
Standard InChI (Main Layer) InChI=1S/C23H32O4/c1-15(2)23(25)13-12-22(4)11-10-16(3)14-19(20(22)23)27-21(24)17-6-8-18(26-5)9-7-17/h6-10,15,19-20,25H,11-14H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 327

Link

ChEMBL

By standard InChI CHEMBL465265
By standard InChI Main Layer CHEMBL465265

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Apiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ferula kuhistanica 52470 Apiaceae asterids Viridiplantae
Ferula kumistanica 52470 Apiaceae asterids Viridiplantae

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P03372 Estrogen receptor NR3A1 CHEMBL465265 CHEMBL1004750 (1)
1 / 1

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (1)

OMIM preferred title UniProt
#615363 Estrogen resistance; estrr P03372

KEGG DISEASE (1)

KEGG disease name UniProt
H00026 Endometrial Cancer P03372 (marker)