PCIDB

KNApSAcK Metabolite C00002515

Metabolite

KNApSAcK Entry

id C00002515
Name Cristacarpin / Erythrabyssin I
CAS RN 74515-47-2
Standard InChI InChI=1S/C21H22O5/c1-12(2)4-6-14-17(24-3)9-8-16-19(14)26-20-15-7-5-13(22)10-18(15)25-11-21(16,20)23/h4-5,7-10,20,22-23H,6,11H2,1-3H3/t20-,21+/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H22O5/c1-12(2)4-6-14-17(24-3)9-8-16-19(14)26-20-15-7-5-13(22)10-18(15)25-11-21(16,20)23/h4-5,7-10,20,22-23H,6,11H2,1-3H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 325

Link

ChEMBL

By standard InChI CHEMBL454849
By standard InChI Main Layer CHEMBL454849

KEGG

By LinkDB C10206

CTD

By CAS RN C085157

Human Protein / Gene in interaction

2 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
Q92731 Estrogen receptor beta NR3A2 CHEMBL454849 CHEMBL1106814 (1)
0 / 1
P03372 Estrogen receptor NR3A1 CHEMBL454849 CHEMBL1106813 (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)
Q92731 (marker)