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Substance Name: Allylestrenol [INN:BAN:JAN]
RN: 432-60-0
UNII: I47VB5DZ8O
InChIKey: ATXHVCQZZJYMCF-XUDSTZEESA-N

Note

  • A synthetic steroid with progestational activity.

Molecular Formula

  • C21-H32-O

Molecular Weight

  • 300.4828
 

Classification Codes

  • Hormone
  • Hormones
  • Hormones, Hormone Substitutes, and Hormone Antagonists
  • Human Data
  • Progestins
  • Reproductive Effect
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Names and Synonyms

Name of Substance

  • Allylestrenol
  • Allylestrenol [INN:BAN:JAN]

MeSH Heading

  • Allylestrenol

Synonyms

  • 17-(2-Propenyl)estr-4-en-17-ol
  • 17-alpha-Allyl-17-beta-hydroxy-4-estrene
  • 17-alpha-Allyl-17-beta-hydroxy-delta(sup 4)-estren
  • 17-alpha-Allyl-3-deoxy-19-nortestosterone
  • 17-alpha-Allyl-4-oestrene-17-beta-ol
  • 17-alpha-Allylestr-4-en-17-beta-ol
  • 17-alpha-Allylhydroxy-19-nor-4-androstene
  • 17-Hydroxy-17-alpha-allyl-4-estrene
  • 17alpha-Allyl-17beta-hydroxy-4-estrene
  • 17alpha-Allyl-19-nor-delta-4-androstene-17beta-ol
  • 17alpha-Allyl-3-deoxy-19-nortestosterone
  • 17alpha-Allyl-4-destrene-17beta-ol
  • 17alpha-Allyl-4-estren-17beta-ol
  • 17alpha-Allyl-4-oestrene-17beta-ol
  • 17alpha-Allylestrenol
  • 19-Nor-17-alpha-preg-4-en-17-ol, 21-methylene-
  • 21-Methylene-19-nor-17-alpha-preg-4-en-17-ol
  • 3-Deoxy-17-alpha-allyl-19-nortestosterone
  • 4-06-00-04143 (Beilstein Handbook Reference)
  • Alilestrenol
  • Alilestrenol [INN-Spanish]
  • Allilestrenolo
  • Allilestrenolo [DCIT]
  • Allylestrenol
  • Allylestrenolum
  • Allylestrenolum [INN-Latin]
  • Allyloestrenol
  • Allyloestrenolum
  • BRN 3148038
  • CCRIS 9068
  • EINECS 207-082-9
  • Estrenol, allyl-
  • Gestanin
  • Gestanol
  • Gestanon
  • Gestanyn
  • NSC 37723
  • Orageston
  • Organon
  • Turinal
  • UNII-I47VB5DZ8O

Systematic Names

  • 17alpha-Allylestr-4-en-17beta-ol
  • Allylestrenol
  • Estr-4-en-17-beta-ol, 17-allyl-
  • Estr-4-en-17-ol, 17-(2-propenyl)-, (17beta)- (9CI)
  • Estr-4-en-17beta-ol, 17-allyl- (8CI)

Registry Numbers

CAS Registry Number

  • 432-60-0

FDA UNII

  • I47VB5DZ8O

System Generated Number

  • 0000432600

Structure Descriptors

InChI

1S/C21H32O/c1-3-12-21(22)14-11-19-18-9-8-15-6-4-5-7-16(15)17(18)10-13-20(19,21)2/h3,6,16-19,22H,1,4-5,7-14H2,2H3/t16-,17+,18+,19-,20-,21-/m0/s1

InChIKey

ATXHVCQZZJYMCF-XUDSTZEESA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 640mg/kg (640mg/kg)   Drugs in Japan Vol. 6, Pg. 41, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 80 deg C   EXP
log P (octanol-water) 5.880 (none)   EST
Atmospheric OH Rate Constant 1.43E-10 cm3/molecule-sec 25 EST

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