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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 25-36 of 46

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  1. 6β-Hydroxylevonorgestrel
      Grade & Purity: 
    • ≥95%
    Cas Number: 55555-97-0        Compound CID:  129318271
    Formula:  C21H28O3        Molecular Weight: 328.45
    IUPAC Name:  (6R,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-6,17-dihydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CCC12CCC3C4CCC(=O)C=C4C(CC3C1CCC2(C#C)O)O
    InChIKey: LUDPEOWAWHAHEP-JUYLZWBTSA-N
    InChI:  InChI=1S/C21H28O3/c1-3-20-9-7-15-14-6-5-13(22)11-17(14)19(23)12-16(15)18(20)8-10-21(20,24)4-2/h2,11,14-16,18-19,23-24H,3,5-10,12H2,1H3/t14-,15-,16-,18show more
    Synonyms: 6beta-Hydroxylevonorgestrel | 18,19-DINORPREGN-4-EN-20-YN-3-ONE, 13-ETHYL-6,17-DIHYDROXY-, (6.BETA.,17.ALPHA.)- | AKO...
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  2. 6α-Hydroxyestradiol
      Grade & Purity: 
    • ≥95%
    Cas Number: 1229-24-9
    Formula:  C18H24O3        Molecular Weight: 288.38
    IUPAC Name:  (6S,8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,6,17-triol
    SMILES:  CC12CCC3C(C1CCC2O)CC(C4=C3C=CC(=C4)O)O
    InChIKey: QZZRQURPSRWTLG-WOVZSMEKSA-N
    InChI:  InChI=1S/C18H24O3/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/h2-3,8,12-13,15-17,19-21H,4-7,9H2,1H3/t12-,13-,15+,16+,17+,18+/m1show more
    Synonyms: Estra-1,3,5(10)-triene-3,6,17-triol, (6.alpha.,17.beta.)- | 6.ALPHA.-HYDROXY-17.BETA.-ESTRADIOL | IL75Q4KU3Q | (1S,3a...
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  3. 6-Dehydroestrone
      Grade & Purity: 
    • ≥95%
    Cas Number: 2208-12-0
    Formula:  C18H20O2        Molecular Weight: 268.35
    IUPAC Name:  (8R,9S,13S,14S)-3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-17-one
    SMILES:  CC12CCC3C(C1CCC2=O)C=CC4=C3C=CC(=C4)O
    InChIKey: WTRRIQCGCGCMQA-CBZIJGRNSA-N
    InChI:  InChI=1S/C18H20O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2-5,10,14-16,19H,6-9H2,1H3/t14-,15-,16+,18+/m1/s1
    Synonyms: estra-1,3,5(10),6-tetraen-3-ol-17-one | SCHEMBL6438746 | delta6,7-Estrone | Q27115999 | 1,5(10),6-Estratetrien-3.beta...
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  4. α-Estradiol
    Cas Number: 57-91-0        EC Number: 200-354-8
    Formula:  C18H24O2        Molecular Weight: 272.39
    IUPAC Name:  (8R,9S,13S,14S,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
    SMILES:  CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O
    InChIKey: VOXZDWNPVJITMN-SFFUCWETSA-N
    InChI:  InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1
    Synonyms: CCRIS 7203 | Estra-1,3,5(10)-triene-3,17alpha-diol | NCGC00161666-02 | Alfatradiol;Epiestradiol;Epiestrol | LMST02010...
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  5. Gestrinone
      Grade & Purity: 
    • ≥99%
    Cas Number: 16320-04-0
    Formula:  C21H24O2        Molecular Weight: 308.4
    IUPAC Name:  (8S,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CCC12C=CC3=C4CCC(=O)C=C4CCC3C1CCC2(C#C)O
    InChIKey: BJJXHLWLUDYTGC-ANULTFPQSA-N
    InChI:  InChI=1S/C21H24O2/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/h2,9,11,13,18-19,23H,3,5-8,10,12H2,1H3/t18-,19+,20+,21+/m1/show more
    Synonyms: 13-ethyl-17-hydroxy-18,19-Dinor-17a-pregna-4,9,11-trien-20-yn-3-one | Gestrinona | Gestrinone | Nemestran | R 2323 | ...
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  6. Altrenogest
      Grade & Purity: 
    • ≥99%
    Cas Number: 850-52-2        EC Number: 212-703-1
    Formula:  C21H26O2        Molecular Weight: 310.43
    IUPAC Name:  (8S,13S,14S,17R)-17-hydroxy-13-methyl-17-prop-2-enyl-1,2,6,7,8,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
    SMILES:  CC12C=CC3=C4CCC(=O)C=C4CCC3C1CCC2(CC=C)O
    InChIKey: VWAUPFMBXBWEQY-ANULTFPQSA-N
    InChI:  InChI=1S/C21H26O2/c1-3-10-21(23)12-9-19-18-6-4-14-13-15(22)5-7-16(14)17(18)8-11-20(19,21)2/h3,8,11,13,18-19,23H,1,4-7,9-10,12H2,2H3/t18-,19+,20+,21+/mshow more
    Synonyms: 9-Fluoro-16-hydroxyhydrocortisone | Estra-4,9,11-trien-3-one, 17beta-hydroxy-17-(2-propenyl)- | IDI1_007563 | NCGC001...
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  7. 4-Hydroxy Estrone-d4
      Grade & Purity: 
    • ≥95 atom% D,≥98%
    Cas Number: 81586-98-3
    Formula:  C18H18D4O3        Molecular Weight: 290.39
    IUPAC Name:  (8R,9S,13S,14S)-1,2,16,16-tetradeuterio-3,4-dihydroxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-one
    SMILES:  CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4O)O
    InChIKey: XQZVQQZZOVBNLU-RFZGAVBWSA-N
    InChI:  InChI=1S/C18H22O3/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/h4,6,11-12,14,19,21H,2-3,5,7-9H2,1H3/t11-,12-,14+,18+/m1/s1/i4D,6show more
    Synonyms: 3,4-Dihydroxyestra-1,3,5(10)-trien-17-one-d4 | F91004 | 4-Hydroxy Estrone-d4 | HY-W009300S | (8R,9S,13S,14S)-1,2,16,1...
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  8. 2-Methoxyestradiol (2-MeOE2)
    Cas Number: 362-07-2
    Formula:  C19H26O3        Molecular Weight: 302.41
    IUPAC Name:  (8R,9S,13S,14S,17S)-2-methoxy-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)OC)O
    InChIKey: CQOQDQWUFQDJMK-SSTWWWIQSA-N
    InChI:  InChI=1S/C19H26O3/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/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/sshow more
    Synonyms: 2-MeOE2 | 2-Methoxyestradiol | 2-ME2 | NSC-659853 | 2-Methoxy-β-estradiol | (8R,9S,13S,14S,17S)-2-Methoxy-13-methyl-7...
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  9. 2-Hydroxy-17β-estradiol
      Grade & Purity: 
    • ≥95%
    Cas Number: 362-05-0
    Formula:  C18H24O3        Molecular Weight: 288.38
    IUPAC Name:  (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-2,3,17-triol
    SMILES:  CC12CCC3C(C1CCC2O)CCC4=CC(=C(C=C34)O)O
    InChIKey: DILDHNKDVHLEQB-XSSYPUMDSA-N
    InChI:  InChI=1S/C18H24O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,17,19-21H,2-7H2,1H3/t11-,12+,14-,17-,18-/m0/s1
    Synonyms: 2-hydroxy-17beta-estradiol | 2-Hydroxyestradiol, analytical standard | 2-bromo-1-(4-fluorophenyl) ethanone | 2-Hydrox...
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  10. 2-Hydroxy Estrone
    Cas Number: 362-06-1
    Formula:  C18H22O3        Molecular Weight: 286.37
    IUPAC Name:  (8R,9S,13S,14S)-2,3-dihydroxy-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)O)O
    InChIKey: SWINWPBPEKHUOD-JPVZDGGYSA-N
    InChI:  InChI=1S/C18H22O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,19-20H,2-7H2,1H3/t11-,12+,14-,18-/m0/s1
    Synonyms: Catecholestrone
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  11. 16-Epiestriol
      Grade & Purity: 
    • ≥90%
    Cas Number: 547-81-9
    Formula:  C18H24O3        Molecular Weight: 288.38
    IUPAC Name:  (8R,9S,13S,14S,16S,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-ZMSHIADSSA-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: 8XZ32LI44K | Estra-1,3,5(10)-triene-3,16.beta.,17.beta.-triol | NSC-758892 | Epiestriol | Q24897913 | NSC 26646 | Est...
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  12. 16α-Hydroxy Estrone
      Grade & Purity: 
    • ≥95%
    Cas Number: 566-76-7
    Formula:  C18H22O3        Molecular Weight: 286.37
    IUPAC Name:  (8R,9S,13S,14S,16R)-3,16-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
    SMILES:  CC12CCC3C(C1CC(C2=O)O)CCC4=C3C=CC(=C4)O
    InChIKey: WPOCIZJTELRQMF-QFXBJFAPSA-N
    InChI:  InChI=1S/C18H22O3/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/h3,5,8,13-16,19-20H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,18+/m1/s1
    Synonyms: 3,16-Dihydroxyestra-1,3,5(10)-trien-17-one # | A-Hydroxyestrone | 3,16alpha-Dihydroxyestra-1,3,5(10)-trien-17-one (16...
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