Gestodene
CAS Registry Number®
60282-87-3
No image available.
CAS Name
GestodeneMolecular Formula
C21H26O2Molecular Mass
310.43Cite this Page
Gestodene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=60282-87-3 (retrieved ) (CAS RN: 60282-87-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
197.9 °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/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,10,12-13,16-19,23H,3,5-9,11H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1
InChIKey
InChIKey=SIGSPDASOTUPFS-XUDSTZEESA-N
SMILES
C(C)[C@@]12[C@]([C@]3([C@](CC1)([C@@]4(C(CC3)=CC(=O)CC4)[H])[H])[H])(C=C[C@]2(C#C)O)[H]
Canonical SMILES
O=C1C=C2CCC3C4C=CC(O)(C#C)C4(CC)CCC3C2CC1
Other Names for this Substance
- 18,19-Dinorpregna-4,15-dien-20-yn-3-one, 13-ethyl-17-hydroxy-, (17α)-
- (17α)-13-Ethyl-17-hydroxy-18,19-dinorpregna-4,15-dien-20-yn-3-one
- Gestodene
- WL 70
- SHB 331
Deleted or Replaced CAS Registry Numbers
110541-55-4
