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Substance Name: Estrone 3-bromoacetate
RN: 81949-03-3
InChIKey: FSFWWKULPXXGBH-PEGLFZIPSA-N

Molecular Weight

  • 393.2917
 
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Names and Synonyms

Name of Substance

  • Estrone 3-bromoacetate

Synonyms

  • 3-Bromoacetoxyestrone
  • Estrone 3-bromoacetic acid

Systematic Name

  • Estra-1,3,5(10)-trien-17-one, 3-((bromoacetyl-2-14C)oxy)-

Registry Numbers

CAS Registry Number

  • 81949-03-3

System Generated Number

  • 0081949033

Structure Descriptors

InChI

1S/C20H23BrO3/c1-20-9-8-15-14-5-3-13(24-19(23)11-21)10-12(14)2-4-16(15)17(20)6-7-18(20)22/h3,5,10,15-17H,2,4,6-9,11H2,1H3/t15-,16-,17+,20+/m1/s1/i11+2

InChIKey

FSFWWKULPXXGBH-PEGLFZIPSA-N

Smiles

C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CCC2=O)OC(=O)[14CH2]Br