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Concept information

Preferred term

17alpha-chloroethynylestradiol  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C20H23ClO2

inchi

  • InChI=1S/C20H23ClO2/c1-19-8-6-16-15-5-3-14(22)12-13(15)2-4-17(16)18(19)7-9-20(19,23)10-11-21/h3,5,12,16-18,22-23H,2,4,6-9H2,1H3/t16-,17-,18+,19+,20-/m1/s1

inchikey

  • RGENIWJSHAAOMP-SWBPCFCJSA-N

mass

  • 330.84800

monoisotopicmass

  • 330.13866

smiles

  • C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)C#CCl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79593

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