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4-Hydroxyethynylestradiol
[CAS# 50394-90-6]

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Identification
Name 4-Hydroxyethynylestradiol
Synonyms 19-Norpregna-1,3,5(10)-Trien-20-Yne-3,4,17-Triol, (17Alpha)-; 19-Norpregna-1,3,5(10)-Trien-20-Yne-3,4,17Alpha-Triol; 4-Hydroxyethynylestradiol
Molecular Structure CAS#: 50394-90-6, 4-Hydroxyethynylestradiol
Molecular Formula C20H24O3
Molecular Weight 312.41
CAS Registry Number 50394-90-6
SMILES [C@H]34[C@H]1[C@@H](C2=C(CC1)C(=C(O)C=C2)O)CC[C@@]3(C(O)(CC4)C#C)C
InChI 1S/C20H24O3/c1-3-20(23)11-9-16-14-4-5-15-12(6-7-17(21)18(15)22)13(14)8-10-19(16,20)2/h1,6-7,13-14,16,21-23H,4-5,8-11H2,2H3/t13-,14-,16+,19+,20?/m1/s1
InChIKey SYFHJXSYRPNSOI-DFJNYNKPSA-N
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