General Information of the Compound
| Compound ID |
CP0648775
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| Compound Name |
SID8139980
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| Synonyms |
(17beta)-17-ethynyl-3-(methyloxy)estra-1,3,5(10)-trien-17-ol
17-Ethynyl-3-methoxy-1,3,5(10)-oestratien-17-beta-ol
17-Ethynyl-3-methoxyestra-1,3,5(10)-trien-17-ol
17-Ethynylestradiol 3-methyl ether
17-Ethynyloestradiol 3-methyl ether
17-alpha-Ethinyl estradiol 3-methyl ether
17-alpha-Ethinyl oestradiol 3-methyl ether
17-alpha-Ethynyl-3-methoxy-1,3,5(10)-estratrien-17-beta-ol
17-alpha-Ethynyloestradiol methyl ether
17-ethynyl-3-methoxyestra-1(10),2,4-trien-17beta-ol
17-ethynyl-3-methoxyoestra-1(10),2,4-trien-17beta-ol
17alpha-Ethinyl estradiol 3-methyl ether
17alpha-Ethinyl oestradiol 3-methyl ether
17alpha-Ethinylestradiol 3-methyl ether
17alpha-Ethynylestradiol 3-methyl ether
17alpha-Ethynylestradiol methyl ether
17alpha-Ethynyloestradiol 3-methyl ether
17beta-Estradiol, 17-ethynyl-, 3-(methyl ether)
3-Methoxy-17-alpha-19-norpregna-1,3,5(10)-trien-20-yn-17-ol
3-Methoxy-17-alpha-ethinylestradiol
3-Methoxy-17-alpha-ethinyloestradiol
3-Methoxy-17-alpha-ethynyl-1,3,5(10)-estratrien-17-beta-ol
3-Methoxy-17-alpha-ethynyl-1,3,5(10)-oestratrien-17-beta-ol
3-Methoxy-17-alpha-ethynylestradiol
3-Methoxy-17-alpha-ethynyloestradiol
3-Methoxy-17-ethynyloestradiol-17-beta
3-Methoxy-17alpha-ethinylestradiol
3-Methoxy-17alpha-ethinyloestradiol
3-Methoxy-17alpha-ethynyl-1,3,5(10)-estratrien-17beta-ol
3-Methoxy-17alpha-ethynyl-1,3,5(10)-oestratrien-17beta-ol
3-Methoxy-17alpha-ethynylestradiol
3-Methoxy-17alpha-ethynyloestradiol
3-Methoxy-19-nor-17-alpha-pregna-1,3,5(10)-trien-20-yn-17-ol
3-Methoxy-19-nor-17alpha-pregna-1,3,5(10)-trien-20-yn-17-ol
3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17beta-ol
3-Methoxyethynylestradiol
3-Methoxyethynyloestradiol
3-Methylethynylestradiol
3-Methylethynyloestradiol
3-O-Methylethynylestradiol
Alpha.-19-Norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-meth
Component of Norinyl
Component of Norquen
Component of Ortho-Novum
Component of Ovulen
Delta-MVE
Devocin
EE(sub3)ME
EE3ME
Ethinyl Estradiol 3 Methyl Ether
EthinylEstradiol 3-Methyl Ether
Ethinylestradiol 3-methyl ether
Ethinyloestradiol 3-methyl ether
Ethynylestradiol 3-methyl ether
Ethynylestradiol methyl ether
Ethynyloestradiol 3-methyl ether
Inostral (steroid)
Menophase
Mestranol
Mestranol (JP15/USP/INN)
Mestranol [Steroidal oestrogens]
Mestranol [USAN:INN:BAN:JAN]
Mestranolo
Mestranolo [DCIT]
Mestranolum
Mestranolum [INN-Latin]
Norquen
Ovastol
SC 4725
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| Structure |
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| Formula |
C21H26O2
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| Molecular Weight |
310.437
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| Canonical SMILES |
C#C[C@]1(O)CC[C@H]2[C@@H]3CCc4cc(OC)ccc4[C@H]3CC[C@@]21C
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| InChI |
InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3/t17-,18-,19+,20+,21+/m1/s1
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| InChIKey |
IMSSROKUHAOUJS-MJCUULBUSA-N
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| CAS |
43085-54-7
72-33-3
53445-46-8
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound