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Substance Name: Androst-4-ene-3-beta,17-beta-diol, 17-(1-methylallyl)-, 3-acetate
ID: BV81005000
InChIKey: BELQHUBCBIWONV-KYUKHQATSA-N

Classification Codes

  • Hormone
  • Reproductive Effect

Molecular Formula

  • C25-H38-O3

Molecular Weight

  • 386.5722
 
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Names and Synonyms

Synonyms

  • 17-(1-Methylallyl)androst-4-ene-3-beta,17-beta-diol 3-acetate
  • 17-alpha-1-Methallyl-19-nor-delta(sup 4)-androstene-3-beta,17-beta-diol-3-acetate

Systematic Name

  • Androst-4-ene-3-beta,17-beta-diol, 17-(1-methylallyl)-, 3-acetate

Registry Numbers

ID Number

  • NIOSH/BV8100500

System Generated Number

  • BV81005000

Structure Descriptors

InChI

1S/C25H38O3/c1-6-16(2)25(27)14-11-22-20-8-7-18-15-19(28-17(3)26)9-12-23(18,4)21(20)10-13-24(22,25)5/h6,15-16,19-22,27H,1,7-14H2,2-5H3/t16?,19-,20+,21-,22-,23-,24-,25+/m0/s1

InChIKey

BELQHUBCBIWONV-KYUKHQATSA-N

Smiles

CC(C=C)[C@]1(O)CC[C@H]2[C@@H]3CCC4=C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)C