CAS Registry Number®
72-33-3
CAS Name
Mestranol
Molecular Formula
C21H26O2
Molecular Mass
310.43
Compound Properties
-
Melting Point (1)
150-151 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
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
InChIKey
InChIKey=IMSSROKUHAOUJS-MJCUULBUSA-N
SMILES
C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(OC)=CC4)(CC1)[H])[H])(CC[C@]2(C#C)O)[H]
Canonical SMILES
C#CC1(O)CCC2C3CCC4=CC(OC)=CC=C4C3CCC21C
Other Names for this Substance
- 19-Norpregna-1,3,5(10)-trien-20-yn-17-ol, 3-methoxy-, (17α)-
- 19-Nor-17α-pregna-1,3,5(10)-trien-20-yn-17-ol, 3-methoxy-
- (17α)-3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17-ol
- 33355
- Ethynylestradiol 3-methyl ether
- 17α-Ethynylestradiol 3-methyl ether
- 17-Ethynyl-3-methoxy-1,3,5(10)-estratrien-17β-o1
- 17α-Ethynyl-3-methoxy-17β-hydroxy-Δ1,3,5(10)-estratriene
- Mestranol
- 3-Methoxy-17α-ethinylestradiol
- 3-Methoxyethynylestradiol
- 3-Methoxy-19-nor-17α-pregna-1,3,5(10)-trien-20-yn-17-ol
- δ-MVE
- 3-Methoxy-17α-ethynylestradiol
- SC 4725
- 17α-Ethinylestradiol 3-methyl ether
- Ethinylestradiol 3-methyl ether
- 3-Methoxy-19-nor-17α-pregna-1,3,5(10)-trien-20-yn-17β-ol
- 17α-Ethynylestradiol methyl ether
- 17-Ethynylestradiol 3-methyl ether
- 17-Ethynyl-3-methoxyestra-1,3,5(10)-trien-17β-ol
- 17α-Ethynyl-3-methoxy-1,3,5(10)-estratrien-17β-ol
Deleted or Replaced CAS Registry Numbers
43085-54-7, 53445-46-8
