PCIDB

KNApSAcK Metabolite C00003038

Metabolite

KNApSAcK Entry

id C00003038
Name (+)-R-Citronellol / (R)-beta-Citronellol / (R)-3,7-Dimethyl-6-octen-1-ol
CAS RN 1117-61-9
Standard InChI InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3/t10-/m1/s1
Standard InChI (Main Layer) InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3

Cluster

Phytochemical cluster No. 34
KCF-S cluster No. 1948

Link

ChEMBL

By standard InChI CHEMBL1907993
By standard InChI Main Layer CHEMBL395827 CHEMBL1907993 CHEMBL1907995

KEGG

By LinkDB C09849

CTD

By CAS RN

Human Protein / Gene in interaction

7 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P35354 Prostaglandin G/H synthase 2 Oxidoreductase CHEMBL395827 CHEMBL1014033 (1)
0 / 3
P00352 Retinal dehydrogenase 1 Enzyme CHEMBL395827 CHEMBL1614458 (1)
0 / 0
O60656 UDP-glucuronosyltransferase 1-9 Enzyme CHEMBL1907993 CHEMBL1907995 CHEMBL1908086 (2)
0 / 0
Q9Y4X1 UDP-glucuronosyltransferase 2A1 Enzyme CHEMBL1907993 CHEMBL1907995 CHEMBL1908088 (2)
0 / 0
P16050 Arachidonate 15-lipoxygenase Enzyme CHEMBL395827 CHEMBL1614240 (1)
0 / 0
P22309 UDP-glucuronosyltransferase 1-1 Enzyme CHEMBL395827 CHEMBL1907993 CHEMBL1908080 (2)
5 / 1
Q16236 Nuclear factor erythroid 2-related factor 2 Unclassified protein CHEMBL395827 CHEMBL2114890 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (5)

OMIM preferred title UniProt
#601816 Bilirubin, serum level of, quantitative trait locus 1; biliqtl1 P22309
#218800 Crigler-najjar syndrome, type i P22309
#606785 Crigler-najjar syndrome, type ii P22309
#143500 Gilbert syndrome P22309
#237900 Hyperbilirubinemia, transient familial neonatal; hblrtfn P22309

KEGG DISEASE (4)

KEGG disease name UniProt
H00208 Hyperbilirubinemia P22309 (related)
H00017 Esophageal cancer P35354 (related)
H00025 Penile cancer P35354 (related)
H00046 Cholangiocarcinoma P35354 (related)