CHEBI:7628 - norethisterone acetate

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ChEBI Name norethisterone acetate ChEBI ID CHEBI:7628 Definition A 3-oxo Δ4-steroid that is norethisterone in which the hydroxy group has been converted to its acetate ester. 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 Wikipedia License Read full article at Wikipedia Formula C22H28O3 Net Charge 0 Average Mass 340.45590 Monoisotopic Mass 340.20384 InChI InChI=1S/C22H28O3/c1-4-22(25-14(2)23)12-10-20-19-7-5-15-13-16(24)6-8-17(15)18(19)9-11-21(20,22)3/h1,13,17-20H,5-12H2,2-3H3/t17-,18+,19+,20-,21-,22-/m0/s1 InChIKey IMONTRJLAWHYGT-ZCPXKWAGSA-N SMILES CC(=O)O[C@]1(CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]12C)C#C Roles Classification Biological Role(s): progestin A synthetic progestogen. Application(s): synthetic oral contraceptive An oral contraceptive which owes its effectiveness to synthetic preparation. View more via ChEBI Ontology ChEBI Ontology Outgoing norethisterone acetate (CHEBI:7628) has functional parent norethisterone (CHEBI:7627) norethisterone acetate (CHEBI:7628) has role progestin (CHEBI:59826) norethisterone acetate (CHEBI:7628) has role synthetic oral contraceptive (CHEBI:49326) norethisterone acetate (CHEBI:7628) is a 3-oxo-Δ4 steroid (CHEBI:47909) norethisterone acetate (CHEBI:7628) is a acetate ester (CHEBI:47622) norethisterone acetate (CHEBI:7628) is a terminal acetylenic compound (CHEBI:73477) IUPAC Name (17α)-3-oxo-19-norpregn-4-en-20-yn-17-yl acetate Synonyms Sources (17-α)-norethindrone acetate ChemIDplus 17-acetoxy-19-nor-17-α-pregn-4-en-20-yn-3-one ChemIDplus 17-acetoxy-19-nor-17α-pregn-4-en-20-yn-3-one ChemIDplus 17-acetyloxy(17-α)-19-norpregn-4-estren-17-β-ol-acetate-3-one ChemIDplus 17-α-ethinyl-19-nortestosterone acetate ChemIDplus 17-α-ethinyl-19-nortestosterone-17-β-acetate ChemIDplus 17-α-ethynyl-17-hydroxyestr-4-en-3-one acetate ChemIDplus 17-α-ethynyl-19-nortestosterone acetate ChemIDplus 17-hydroxy-19-nor-17-α-pregn-4-en-20-yn-3-one acetate ChemIDplus 17-hydroxy-19-nor-17α-pregn-4-en-20-yn-3-one acetate ChemIDplus 17α-ethinyl-19-nortestosterone 17β-acetate ChemIDplus 17α-ethinyl-19-nortestosterone-17β-acetate ChemIDplus 17α-ethynyl-17-hydroxyestr-4-en-3-one acetate ChemIDplus 17α-ethynyl-17β-acetoxy-19-norandrost-4-en-3-one ChemIDplus 17α-ethynyl-19-nortestosterone acetate ChemIDplus 17β-acetoxy-19-nor-17α-pregn-4-en-20-yn-3-one ChemIDplus 17β-hydroxy-19-nor-17α-pregn-4-en-20-yn-3-one acetate ChemIDplus 19-norethindrone acetate ChemIDplus 19-norethisterone acetate ChemIDplus 19-norethynyltestosterone acetate ChemIDplus norethindrone 17-acetate ChemIDplus norethindrone acetate ChemIDplus Norethindrone acetate KEGG COMPOUND norethisterone acetate ChemIDplus Brand Names Sources Aygestin KEGG DRUG Norlutate ChEBI Manual Xrefs Databases 1963 DrugCentral C08152 KEGG COMPOUND D00953 KEGG DRUG Norethisterone_acetate Wikipedia US2964537 Patent View more database links Registry Numbers Types Sources 2064104 Reaxys Registry Number Reaxys 51-98-9 CAS Registry Number ChemIDplus 51-98-9 CAS Registry Number NIST Chemistry WebBook Citations Types Sources 19820247 PubMed citation Europe PMC 22505834 PubMed citation Europe PMC 22999413 PubMed citation Europe PMC 484634 PubMed citation Europe PMC Last Modified 22 February 2017