CHEBI:6715 - medroxyprogesterone

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ChEBI Name medroxyprogesterone ChEBI ID CHEBI:6715 Definition A 3-oxo Δ4-steroid that is pregn-4-ene-3,20-dione substituted by an α-hydroxy group at position 17 and a methyl group at position 6. 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 C22H32O3 Net Charge 0 Average Mass 344.495 Monoisotopic Mass 344.23514 InChI InChI=1S/C22H32O3/c1-13-11-16-17(20(3)8-5-15(24)12-19(13)20)6-9-21(4)18(16)7-10-22(21,25)14(2)23/h12-13,16-18,25H,5-11H2,1-4H3/t13-,16+,17-,18-,20+,21-,22-/m0/s1 InChIKey FRQMUZJSZHZSGN-HBNHAYAOSA-N SMILES C1[C@]2([C@]3([C@@]([C@@]4(C(=CC(CC4)=O)[C@H](C3)C)C)(CC[C@@]2([C@@](C1)(O)C(=O)C)C)[H])[H])[H] Roles Classification Biological Role(s): progestin A synthetic progestogen. Application(s): contraceptive drug A chemical substance that prevents or reduces the probability of conception. synthetic oral contraceptive An oral contraceptive which owes its effectiveness to synthetic preparation. View more via ChEBI Ontology ChEBI Ontology Outgoing medroxyprogesterone (CHEBI:6715) has role contraceptive drug (CHEBI:49323) medroxyprogesterone (CHEBI:6715) has role progestin (CHEBI:59826) medroxyprogesterone (CHEBI:6715) has role synthetic oral contraceptive (CHEBI:49326) medroxyprogesterone (CHEBI:6715) is a 17α-hydroxy steroid (CHEBI:35342) medroxyprogesterone (CHEBI:6715) is a 20-oxo steroid (CHEBI:36885) medroxyprogesterone (CHEBI:6715) is a 3-oxo-Δ4 steroid (CHEBI:47909) medroxyprogesterone (CHEBI:6715) is a tertiary α-hydroxy ketone (CHEBI:139592) Incoming medroxyprogesterone acetate (CHEBI:6716) has functional parent medroxyprogesterone (CHEBI:6715) IUPAC Name (6α)-17-hydroxy-6-methylpregn-4-ene-3,20-dione INNs Sources medroxiprogesterona ChemIDplus médroxyprogestérone ChEBI medroxyprogesterone ChemIDplus medroxyprogesteronum ChemIDplus Synonyms Sources 17-Hydroxy-6α-methyl-pregn-4-ene-3,20-dione ChemIDplus 17-Hydroxy-6α-methylprogesterone ChemIDplus 17α-Hydroxy-6α-methylprogesterone ChemIDplus 6α-Methyl-17α-hydroxyprogesterone ChemIDplus 6α-Methyl-4-pregnen-17α-ol-3,20-dione ChemIDplus Medroxyprogesteron ChemIDplus Manual Xrefs Databases C07119 KEGG COMPOUND D08166 KEGG DRUG DB00603 DrugBank GB866381 Patent HMDB0001939 HMDB US3043832 Patent US3061616 Patent US3377364 Patent View more database links Registry Numbers Types Sources 2510965 Reaxys Registry Number Reaxys 2510965 Beilstein Registry Number Beilstein 520-85-4 CAS Registry Number ChemIDplus Citations Types Sources 18636214 PubMed citation Europe PMC 31902997 PubMed citation Europe PMC Last Modified 22 January 2020