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Estrogens and derivatives

Description:

Steroids with a structure containing a 3-hydroxylated estrane.

Ancestors:

Organic compounds ⮕ Lipids and lipid-like molecules ⮕ Steroids and steroid derivatives ⮕ Estrane steroids ⮕ Estrogens and derivatives
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Items 37-46 of 46

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  1. D(-)-Norgestrel
    Cas Number: 797-63-7        EC Number: 212-349-8
    Formula:  C21H28O2        Molecular Weight: 312.45
    IUPAC Name:  (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CCC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34
    InChIKey: WWYNJERNGUHSAO-XUDSTZEESA-N
    InChI:  InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1
    Synonyms: Levonorgestrelum | (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro...
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  2. Gestodene
    Cas Number: 60282-87-3
    Formula:  C21H26O2        Molecular Weight: 310.43
    IUPAC Name:  (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14-decahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CCC12CCC3C(C1C=CC2(C#C)O)CCC4=CC(=O)CCC34
    InChIKey: SIGSPDASOTUPFS-XUDSTZEESA-N
    InChI:  InChI=1S/C21H26O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,10,12-13,16-19,23H,3,5-9,11H2,1H3/t16-,17+,18+,19-,20-,2show more
    Synonyms: SHB 331 | WL 70 | (8R,9S,10R,13S,14S,17R)-13-Ethyl-17-ethynyl-17-hydroxy-6,7,8,9,10,11,12,13,14,17-decahydro-1H-cyclo...
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  3. Estriol
    Cas Number: 50-27-1        EC Number: 200-022-2
    Formula:  C18H24O3        Molecular Weight: 288.38
    IUPAC Name:  (8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
    SMILES:  CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O
    InChIKey: PROQIPRRNZUXQM-ZXXIGWHRSA-N
    InChI:  InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/sshow more
    Synonyms: A 13610 | Chlorapatite | Estriol, unconjugated | Overstin | Tridestrin | Estriel (TN) | ESTRIOL [MART.] | Estriol [US...
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  4. Etonogestrel
    Cas Number: 54048-10-1        EC Number: 258-936-2
    Formula:  C22H28O2        Molecular Weight: 324.46
    IUPAC Name:  (8S,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-11-methylidene-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
    SMILES:  CCC12CC(=C)C3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34
    InChIKey: GCKFUYQCUCGESZ-BPIQYHPVSA-N
    InChI:  InChI=1S/C22H28O2/c1-4-21-13-14(3)20-17-9-7-16(23)12-15(17)6-8-18(20)19(21)10-11-22(21,24)5-2/h2,12,17-20,24H,3-4,6-11,13H2,1H3/t17-,18-,19-,20+,21-,2show more
    Synonyms: C75537 | NCGC00168777-04 | 18,19-Dinor-17alpha-pregn-4-en-20-yn-3-one, 13-ethyl-17-hydroxy-11-methylene- | s4673 | (1...
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  5. Fulvestrant
    Cas Number: 129453-61-8
    Formula:  C32H47F5O3S        Molecular Weight: 606.77
    IUPAC Name:  (7R,8R,9S,13S,14S,17S)-13-methyl-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-dishow more
    SMILES:  CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F
    InChIKey: VWUXBMIQPBEWFH-WCCTWKNTSA-N
    InChI:  InChI=1S/C32H47F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h1show more
    Synonyms: Faslodex(ICI 182,780) | FULVESTRANT [MI] | ICI 182,789 | Q27274130 | CAS-129453-61-8 | NCGC00164789-02 | NCGC00164789...
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  6. Estrone
    Cas Number: 53-16-7        EC Number: 200-164-5
    Formula:  C18H22O2        Molecular Weight: 270.37
    IUPAC Name:  (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
    SMILES:  CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)O
    InChIKey: DNXHEGUUPJUMQT-CBZIJGRNSA-N
    InChI:  InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1
    Synonyms: 2DI9HA706A | Cristallovar | delta-1,3,5-estratrien-3-beta-ol-17-one | delta-1,3,5-Estratrien-3beta-ol-17-one | ESTRON...
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  7. Ethinyl Estradiol
    Cas Number: 57-63-6        EC Number: 200-342-2
    Formula:  C20H24O2        Molecular Weight: 296.4
    IUPAC Name:  (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
    SMILES:  CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)O
    InChIKey: BFPYWIDHMRZLRN-SLHNCBLASA-N
    InChI:  InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/show more
    Synonyms: Ethinylestradiol (Standard) | Ethynyloestradiol | Estigyn | 17-Ethinylestradiol | CHEBI:4903 | Ethinyl Estradiol [USP...
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  8. Norethindrone
    Cas Number: 68-22-4        EC Number: 200-681-6
    Formula:  C20H26O2        Molecular Weight: 298.42
    IUPAC Name:  (8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34
    InChIKey: VIKNJXKGJWUCNN-XGXHKTLJSA-N
    InChI:  InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1
    Synonyms: SC 4640 | Brevinor-1 28 | Estrinor | Nodiol | Norcolut | Norethynodron | Norethynodrone | Triella | BRN 1915671 | Nor...
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  9. 6-Ketoestrone
      Grade & Purity: 
    • ≥95%
    Cas Number: 1476-34-2
    Formula:  C18H20O3        Molecular Weight: 284.35
    IUPAC Name:  (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-6,17-dione
    SMILES:  CC12CCC3C(C1CCC2=O)CC(=O)C4=C3C=CC(=C4)O
    InChIKey: JOVYPIGRPWIXHQ-ONUSSAAZSA-N
    InChI:  InChI=1S/C18H20O3/c1-18-7-6-12-11-3-2-10(19)8-14(11)16(20)9-13(12)15(18)4-5-17(18)21/h2-3,8,12-13,15,19H,4-7,9H2,1H3/t12-,13-,15+,18+/m1/s1
    Synonyms: BDBM50370698 | SCHEMBL1977286 | 6-Oxoestrone | 6-oxo-estrone | (8R,9S,13S,14S)-3-hydroxy-13-methyl-7,8,9,11,12,14,15,...
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  10. Estetrol
    Cas Number: 15183-37-6
    Formula:  C18H24O4        Molecular Weight: 304.38
    IUPAC Name:  (8R,9S,13S,14S,15R,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,15,16,17-tetrol
    SMILES:  CC12CCC3C(C1C(C(C2O)O)O)CCC4=C3C=CC(=C4)O
    InChIKey: AJIPIJNNOJSSQC-NYLIRDPKSA-N
    InChI:  InChI=1S/C18H24O4/c1-18-7-6-12-11-5-3-10(19)8-9(11)2-4-13(12)14(18)15(20)16(21)17(18)22/h3,5,8,12-17,19-22H,2,4,6-7H2,1H3/t12-,13-,14-,15-,16-,17+,18+show more
    Synonyms: estra-1,3,5(10)-triene-3,15alpha,16alpha,17beta-tetrol | Drovelis (EMA); ; estetrol monohydrate + drospirenone | EST...
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