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Substance Name: Gestodene [USAN:INN:BAN]
RN: 60282-87-3
UNII: 1664P6E6MI
InChIKey: SIGSPDASOTUPFS-XUDSTZEESA-N

Note

  • Synthetic steroid with progestational activity.

Molecular Formula

  • C21-H26-O2

Molecular Weight

  • 310.4344
 

Classification Codes

  • Contraceptive Agents
  • Contraceptive Agents, Female
  • Contraceptive Agents, Hormonal
  • Contraceptives, Oral
  • Contraceptives, Oral, Hormonal
  • Contraceptives, Oral, Synthetic
  • Hormone
  • Hormones
  • Hormones, Hormone Substitutes, and Hormone Antagonists
  • Progestin
  • Progestins
  • Reproductive Control Agents
  • Reproductive Effect
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Names and Synonyms

Name of Substance

  • Gestodene
  • Gestodene [USAN:INN:BAN]

Synonyms

  • 13-Ethyl-17-hydroxy-18,19-dinor-17alpha-pregna-4,15-dien-20-yn-3-one
  • 17-alpha-Ethinyl-13-ethyl-17-beta-hydroxy-4,15-gonadien-3-one
  • BRN 4237181
  • CCRIS 9189
  • EINECS 262-145-8
  • Gestinol
  • Gestodene
  • Gestodeno
  • Gestodeno [INN-Spanish]
  • Gestodenum
  • Gestodenum [INN-Latin]
  • HSDB 3594
  • SH B 331
  • UNII-1664P6E6MI

Systematic Names

  • 18,19-Dinorpregna-4,15-dien-20-yn-3-one, 13-ethyl-17-hydroxy-, (17-alpha)-
  • Gestodene
  • Pregna-4,15-dien-20-yn-3-one, 13-ethyl-17-hydroxy-18,19-dinor-, (17alpha)-

Registry Numbers

CAS Registry Number

  • 60282-87-3

FDA UNII

  • 1664P6E6MI

Other Registry Number

  • 110541-55-4

System Generated Number

  • 0060282873

Structure Descriptors

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

SIGSPDASOTUPFS-XUDSTZEESA-N

Smiles

CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1C=C[C@@]2(O)C#C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 197.9 deg C   EXP
log P (octanol-water) 3.260 (none)   EST
Atmospheric OH Rate Constant 1.66E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.