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Substance Name: 17-(2-Iodoethynyl)androsta-4,6-dien-17-ol-3-one
RN: 145430-54-2
InChIKey: OLSDNCSWCHMJEW-SJFWLOONSA-N

Note

  • Active site-directed photoaffinity ligand for androgen-binding proteins.

Molecular Weight

  • 436.3265
 
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Names and Synonyms

Name of Substance

  • 17-(2-Iodoethynyl)androsta-4,6-dien-17-ol-3-one

Synonyms

  • 17-Iey-adoo
  • 17alpha-(2-Iodoethynyl)androsta-4,6-dien-17beta-ol-3-one

Registry Numbers

CAS Registry Number

  • 145430-54-2

System Generated Number

  • 0145430542

Structure Descriptors

InChI

1S/C21H25IO2/c1-19-8-5-15(23)13-14(19)3-4-16-17(19)6-9-20(2)18(16)7-10-21(20,24)11-12-22/h3-4,13,16-18,24H,5-10H2,1-2H3/t16-,17+,18+,19+,20+,21-/m1/s1

InChIKey

OLSDNCSWCHMJEW-SJFWLOONSA-N

Smiles

C1(=O)CC[C@]2(C(=C1)C=C[C@H]1[C@@H]3CC[C@@]([C@@]3(C)CC[C@H]21)(O)C#CI)C