CHEBI:190404 - 3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride

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ChEBI Name 3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride
ChEBI ID CHEBI:190404
ChEBI ASCII Name 3beta-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride
Definition A hydrochloride obtained by reaction of 3β-(2-diethylaminoethoxy)androst-5-en-17-one with one equivalent of hydrochloric acid. It is a cholesterol synthesis and transport inhibitor.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C25H41NO2.ClH
Net Charge 0
Average Mass 424.070
Monoisotopic Mass 423.29041
InChI InChI=1S/C25H41NO2.ClH/c1-5-26(6-2)15-16-28-19-11-13-24(3)18(17-19)7-8-20-21-9-10-23(27)25(21,4)14-12-22(20)24;/h7,19-22H,5-6,8-17H2,1-4H3;1H/t19-,20-,21-,22-,24-,25-;/m0./s1
InChIKey GZFYZYBWLCYBMI-MYZJJQSMSA-N
SMILES Cl.[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OCCN(CC)CC
Roles Classification
Biological Role(s): EC 1.3.1.72 (Delta(24)-sterol reductase) inhibitor
An EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD+ or NADP+ as acceptor) inhibitor that interferes with the action of Delta24-sterol reductase (EC 1.3.1.72).
nicotinic antagonist
An antagonist at the nicotinic cholinergic receptor.
sterol biosynthesis inhibitor
Any compound that inhibits the biosynthesis of any sterol.
antiviral agent
A substance that destroys or inhibits replication of viruses.
Hedgehog signaling pathway inhibitor
Any pathway inhibitor that inhibits the Hedgehog signalling pathway.
Application(s): nicotinic antagonist
An antagonist at the nicotinic cholinergic receptor.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) has part 3β-(2-diethylaminoethoxy)androst-5-en-17-one(1+) (CHEBI:190403)
3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) has role antiviral agent (CHEBI:22587)
3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) has role EC 1.3.1.72 (Δ24-sterol reductase) inhibitor (CHEBI:78728)
3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) has role Hedgehog signaling pathway inhibitor (CHEBI:140921)
3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) has role nicotinic antagonist (CHEBI:48878)
3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) has role sterol biosynthesis inhibitor (CHEBI:83317)
3β-(2-diethylaminoethoxy)androst-5-en-17-one hydrochloride (CHEBI:190404) is a hydrochloride (CHEBI:36807)
IUPAC Name
3β-[2-(diethylamino)ethoxy]androst-5-en-17-one hydrochloride
Synonyms Sources
(3β)-3-[2-(diethylamino)ethoxy]androst-5-en-17-one hydrochloride ChEBI
3β-(2-diethylaminoethoxy)androst-5-en-17-one HCl ChEBI
N,N-diethyl-2-[(17-oxoandrost-5-en-3β-yl)oxy]ethanaminium chloride IUPAC
U 18,666A ChemIDplus
U 18666A ChemIDplus
U-18,666A ChemIDplus
U-18666A ChemIDplus
U18666A ChemIDplus
Manual Xrefs Databases
8129692 ChemSpider
WO2010083445 Patent
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Registry Number Type Source
3039-71-2 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
24 March 2022