CHEBI:31649 - teprenone

ChEBI IDCHEBI:31649
ChEBI Nameteprenone
Stars
DefinitionA terpene ketone in which a (9E,13E)-geranylgernayl group is bonded to one of the α-methyls of acetone (it is a mixture of 5E- and 5Z-geoisomers in a 3:2 ratio).
Last Modified22 February 2017
DownloadsMolfile
FormulaC23H38O
Net Charge0
Average Mass330.556
Monoisotopic Mass330.29227
SMILES[H]C(CCC(C)=O)=C(C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C23H38O/c1-19(2)11-7-12-20(3)13-8-14-21(4)15-9-16-22(5)17-10-18-23(6)24/h11,13,15,17H,7-10,12,14,16,18H2,1-6H3/b20-13+,21-15+,22-17?
InChIKeyHUCXKZBETONXFO-AJDZVAQLSA-N
Roles Classification
Biological Role:
Hsp70 inducer  Any inducer of heat shock protein 70.
Applications:
hepatoprotective agent  Any compound that is able to prevent damage to the liver.
nephroprotective agent  Any protective agent that is able to prevent damage to the kidney.
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
cardioprotective agent  Any protective agent that is able to prevent damage to the heart.
anti-ulcer drug  One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.
ChEBI Ontology
Outgoing Relation(s)
teprenone (CHEBI:31649) has part geranylgeranyl group (CHEBI:24231)
teprenone (CHEBI:31649) has role anti-ulcer drug (CHEBI:49201)
teprenone (CHEBI:31649) has role cardioprotective agent (CHEBI:77307)
teprenone (CHEBI:31649) has role hepatoprotective agent (CHEBI:62868)
teprenone (CHEBI:31649) has role Hsp70 inducer (CHEBI:78606)
teprenone (CHEBI:31649) has role nephroprotective agent (CHEBI:76595)
teprenone (CHEBI:31649) has role neuroprotective agent (CHEBI:63726)
teprenone (CHEBI:31649) is a methyl ketone (CHEBI:51867)
teprenone (CHEBI:31649) is a terpene ketone (CHEBI:26872)
IUPAC Name 
(9E,13E)-6,10,14,18-tetramethylnonadeca-5,9,13,17-tetraen-2-one
INNs  Source
teprenonaChemIDplus
teprenoneKEGG DRUG
téprénoneWHO MedNet
teprenonumChemIDplus
Synonym  Source
GeranylgeranylacetoneKEGG COMPOUND
Brand Name  Source
SelbexKEGG DRUG
Manual XrefsDatabases
2596DrugCentral
C13297KEGG COMPOUND
D01827KEGG DRUG
Registry NumbersSources
Reaxys:8717724Reaxys
CAS:6809-52-5KEGG COMPOUND
CAS:6809-52-5ChemIDplus
Citations