PCIDB

KNApSAcK Metabolite C00032467

Metabolite

KNApSAcK Entry

id C00032467
Name Uvaol / Uvalol / Urs-12-ene-3beta,28-diol / 3beta,28-Dihydroxyurs-12-ene
CAS RN 545-46-0
Standard InChI InChI=1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1
Standard InChI (Main Layer) InChI=1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3

Cluster

Phytochemical cluster No. 51
KCF-S cluster No. 13

Link

ChEMBL

By standard InChI CHEMBL399873
By standard InChI Main Layer CHEMBL58872 CHEMBL399873

KEGG

By LinkDB

CTD

By CAS RN C013330

Human Protein / Gene in interaction

5 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P18031 Tyrosine-protein phosphatase non-receptor type 1 Tyr CHEMBL399873 CHEMBL1036591 (1) CHEMBL1106811 (1)
0 / 0
Q8TDU6 G-protein coupled bile acid receptor 1 Steroid-like ligand receptor CHEMBL399873 CHEMBL1041788 (1) CHEMBL1041789 (1)
0 / 0
P28845 Corticosteroid 11-beta-dehydrogenase isozyme 1 Enzyme CHEMBL399873 CHEMBL1072762 (1)
1 / 1
Q96RI1 Bile acid receptor NR1H4 CHEMBL399873 CHEMBL1041790 (1)
0 / 0
P80365 Corticosteroid 11-beta-dehydrogenase isozyme 2 Enzyme CHEMBL399873 CHEMBL1072765 (1)
1 / 1

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (2)

OMIM preferred title UniProt
#218030 Apparent mineralocorticoid excess; ame P80365
#604931 Cortisone reductase deficiency 1; cortrd1 P28845

KEGG DISEASE (2)

KEGG disease name UniProt
H01111 Cortisone reductase deficiency (CRD) P28845 (related)
H00259 Apparent mineralocorticoid excess syndrome P80365 (related)