Estrogens and derivatives

Description:

Steroids with a structure containing a 3-hydroxylated estrane.

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  1. 4-Methoxyestrone
    CAS: 58562-33-7 PubChem CID: 194066 Formula: C19H24O3 Molecular Weight: 300.39
    Out of Stock Item #: M1352569
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    IUPAC Name
    (8R,9S,13S,14S)-3-hydroxy-4-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
    SMILES
    CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4OC)O
    InChIKey
    PUEXVLNGOBYUEW-BFDPJXHCSA-N
    InChI
    1S/C19H24O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,20H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,19+/m1/s1
  2. Trestolone
    CAS: 3764-87-2 EC Number: 658-091-3 PubChem CID: 9838899
    Out of Stock Item #: T1332096
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    IUPAC Name
    (7R,8R,9S,10R,13S,14S,17S)-17-hydroxy-7,13-dimethyl-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-one
    SMILES
    CC1CC2=CC(=O)CCC2C3C1C4CCC(C4(CC3)C)O
    InChIKey
    YSGQGNQWBLYHPE-CFUSNLFHSA-N
    InChI
    1S/C19H28O2/c1-11-9-12-10-13(20)3-4-14(12)15-7-8-19(2)16(18(11)15)5-6-17(19)21/h10-11,14-18,21H,3-9H2,1-2H3/t11-,14+,15-,16+,17+,18-,19+/m1/s1
  3. 4-Methoxyestradiol
    CAS: 26788-23-8 PubChem CID: 68578 Formula: C19H26O3 Molecular Weight: 302.41
    Out of Stock Item #: M1053515
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    IUPAC Name
    (8R,9S,13S,14S,17S)-4-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    SMILES
    CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4OC)O
    InChIKey
    BCWZIZLVBYHFES-PYEWSWHRSA-N
    InChI
    1S/C19H26O3/c1-19-10-9-12-11-5-7-16(20)18(22-2)14(11)4-3-13(12)15(19)6-8-17(19)21/h5,7,12-13,15,17,20-21H,3-4,6,8-10H2,1-2H3/t12-,13-,15+,17+,19+/m1/sshow more
  4. 2-bromo 17β-Estradiol
    CAS: 15833-07-5 PubChem CID: 266713 Formula: C18H23BrO2 Molecular Weight: 351.28
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: B1240612
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    IUPAC Name
    2-bromo-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    SMILES
    CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)Br)O
    InChIKey
    SORISAYAZBCIQH-UHFFFAOYSA-N
    InChI
    1S/C18H23BrO2/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-16(20)15(19)9-13(10)11/h8-9,11-12,14,17,20-21H,2-7H2,1H3
  5. 4-Hydroxyestradiol
    CAS: 5976-61-4 EC Number: 637-368-2 Formula: C18H24O3 Molecular Weight: 288.38
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: H769821
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    IUPAC Name
    (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,4,17-triol
    SMILES
    CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4O)O
    InChIKey
    QOZFCKXEVSGWGS-ZHIYBZGJSA-N
    InChI
    1S/C18H24O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,16,19-21H,2-3,5,7-9H2,1H3/t11-,12-,14+,16+,18+/m1/s1
    Synonyms
    4-Hydroxy-17β-estradiol | 1,3,5(10)-Estratriene-3,4,17β-triol
  6. (7a,17b)-7-(9-Bromononyl)estra-1,3,5(10)-triene-3,17-diol 
    CAS: 875573-67-4 PubChem CID: 71463695 Formula: C27H41BrO2 Molecular Weight: 477.54
    Out of Stock Item #: E734932
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    IUPAC Name
    (7R,8R,9S,13S,14S,17S)-7-(9-bromononyl)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    SMILES
    CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCBr
    InChIKey
    ILWDBZWOZQESSY-NJGGNICLSA-N
    InChI
    1S/C27H41BrO2/c1-27-15-14-23-22-11-10-21(29)18-20(22)17-19(26(23)24(27)12-13-25(27)30)9-7-5-3-2-4-6-8-16-28/h10-11,18-19,23-26,29-30H,2-9,12-17H2,1H3/show more
  7. Estratetraenol
    CAS: 1150-90-9 PubChem CID: 101988 Formula: C18H22O Molecular Weight: 254.37
    Solid ≥98%
    Out of Stock Item #: E695411
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    IUPAC Name
    (8S,9S,13R,14S)-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-ol
    SMILES
    CC12CCC3C(C1CC=C2)CCC4=C3C=CC(=C4)O
    InChIKey
    CRMOMCHYBNOFIV-BDXSIMOUSA-N
    InChI
    1S/C18H22O/c1-18-9-2-3-17(18)16-6-4-12-11-13(19)5-7-14(12)15(16)8-10-18/h2,5,7,9,11,15-17,19H,3-4,6,8,10H2,1H3/t15-,16-,17+,18+/m1/s1
  8. 2-Methoxyestrone 
    CAS: 362-08-3 EC Number: 206-645-6 Formula: C19H24O3 Molecular Weight: 300.39
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%
    Out of Stock Item #: M697708
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    IUPAC Name
    (8R,9S,13S,14S)-3-hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
    SMILES
    CC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)OC)O
    InChIKey
    WHEUWNKSCXYKBU-QPWUGHHJSA-N
    InChI
    1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3/t12-,13+,15-,19-/m0/s1
    Synonyms
    2,3-Dihydroxy-1,3,5(10)-estratrien-17-one 2-methyl ether | 2-Hydroxyestrone 2-methyl ether | 3-Hydroxy-2-methoxy-1,3,...
  9. Fluoroestradiol F-18
    CAS: 94153-53-4 Formula: C18H23FO2 Molecular Weight: 289.4
    Out of Stock Item #: F671089
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    IUPAC Name
    (8R,9S,13S,14S,16R,17R)-16-(18F)fluoranyl-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    SMILES
    CC12CCC3C(C1CC(C2O)F)CCC4=C3C=CC(=C4)O
    InChIKey
    KDLLNMRYZGUVMA-ZYMZXAKXSA-N
    InChI
    1S/C18H23FO2/c1-18-7-6-13-12-5-3-11(20)8-10(12)2-4-14(13)15(18)9-16(19)17(18)21/h3,5,8,13-17,20-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1/i19show more
    Synonyms
    Fluoroestradiol F-18 | Cerianna (TN) | 16alpha-(18F)Fluoro-17beta-estradiol | 16-.alpha.-[18F]-fluoro-17.beta. estrad...
  10. (3aS,3bR,5aS,9aS,9bR,11aS)-11a-methyl-hexadecahydro-1H-cyclopenta[a]phenanthrene-1,7-dione
    CAS: 5696-58-2 PubChem CID: 5288172 Formula: C18H26O2 Molecular Weight: 274.4
    Out of Stock Item #: A669703
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    IUPAC Name
    (5S,8R,9R,10S,13S,14S)-13-methyl-1,2,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,17-dione
    SMILES
    O=C1C[C@@]2([H])[C@@](CC1)([H])[C@]3([H])[C@](CC2)([H])[C@@]4([H])[C@@](CC3)(C)C(=O)CC4
    InChIKey
    CRDKSBHJIGNEOH-IMRIKWHGSA-N
    InChI
    1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h11,13-16H,2-10H2,1H3/t11-,13-,14+,15+,16-,18-/m0/s1
  11. ICI-164384
    CAS: 98007-99-9 PubChem CID: 104772 Formula: C34H55NO3 Molecular Weight: 525.8
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    Out of Stock Item #: N668014
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    IUPAC Name
    N-butyl-11-[(7R,8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl]-N-methylundecanamide
    SMILES
    CCCCN(C)C(=O)CCCCCCCCCCC1CC2=C(C=CC(=C2)O)C3C1C4CCC(C4(CC3)C)O
    InChIKey
    BVVFOLSZMQVDKV-KXQIQQEYSA-N
    InChI
    1S/C34H55NO3/c1-4-5-22-35(3)32(38)15-13-11-9-7-6-8-10-12-14-25-23-26-24-27(36)16-17-28(26)29-20-21-34(2)30(33(25)29)18-19-31(34)37/h16-17,24-25,29-31,show more
    Synonyms
    ICI-164384 | Ici 164384 | ICI 164,384 | ICI M164384 | N-n-Butyl-N-methyl-11-(3,17beta-dihydroxyestra-1,3,5(10)-trien-...
  12. Plomestane
    CAS: 77016-85-4 PubChem CID: 9904788 Formula: C21H26O2 Molecular Weight: 310.4
    Out of Stock Item #: P669037
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    IUPAC Name
    (8R,9S,10S,13S,14S)-13-methyl-10-prop-2-ynyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
    SMILES
    CC12CCC3C(C1CCC2=O)CCC4=CC(=O)CCC34CC#C
    InChIKey
    JKPDEYAOCSQBSZ-OEUJLIAZSA-N
    InChI
    1S/C21H26O2/c1-3-10-21-12-8-15(22)13-14(21)4-5-16-17-6-7-19(23)20(17,2)11-9-18(16)21/h1,13,16-18H,4-12H2,2H3/t16-,17-,18-,20-,21-/m0/s1
    Synonyms
    Plomestane | MDL-18962 | MDL 18,962 | FL3VS913TW | 10-(2-Propynyl)estr-4-ene-3,17-dione | Estr-4-ene-3,17-dione, 10-(...
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