CHEBI:77821 - ent-dextilidine

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ChEBI Name ent-dextilidine ChEBI ID CHEBI:77821 ChEBI ASCII Name ent-dextilidine Definition An ethyl 2-(dimethylamino)-1-phenylcyclohex-3-ene-1-carboxylate that has R configuration at the carbon bearing the phenyl group and S configuration at the carbon bearing the dimethylamino group. It is the enantiomer of dextilidine; the opioid analgesic tilidine is the racemate comprising equimolar amounts of dextilidine and ent-dextilidine. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H23NO2 Net Charge 0 Average Mass 273.37000 Monoisotopic Mass 273.17288 InChI InChI=1S/C17H23NO2/c1-4-20-16(19)17(14-10-6-5-7-11-14)13-9-8-12-15(17)18(2)3/h5-8,10-12,15H,4,9,13H2,1-3H3/t15-,17+/m0/s1 InChIKey WDEFBBTXULIOBB-DOTOQJQBSA-N SMILES CCOC(=O)[C@]1(CCC=C[C@@H]1N(C)C)c1ccccc1 Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing ent-dextilidine (CHEBI:77821) is a ethyl 2-(dimethylamino)-1-phenylcyclohex-3-ene-1-carboxylate (CHEBI:77817) ent-dextilidine (CHEBI:77821) is enantiomer of dextilidine (CHEBI:77822) Incoming tilidine (CHEBI:77823) has part ent-dextilidine (CHEBI:77821) dextilidine (CHEBI:77822) is enantiomer of ent-dextilidine (CHEBI:77821) IUPAC Name ethyl (1R,2S)-2-(dimethylamino)-1-phenylcyclohex-3-ene-1-carboxylate Synonym Source (−)-ethyl trans-2-(dimethylamino)-1-phenylcyclohex-3-ene-1-carboxylate ChEBI Last Modified 20 March 2014