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Substance Name: 18-Ethynyldeoxycorticosterone
RN: 80899-91-8
InChIKey: HEPLOTWQTPMDBG-XREPOJNXSA-N

Molecular Weight

  • 354.487
 
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Names and Synonyms

Name of Substance

  • 18-Ethynyldeoxycorticosterone

Synonyms

  • 18-Acetylenic-deoxycorticosterone
  • 18-E-Doc
  • 18-Ethynyl-deoxycorticosterone

Systematic Name

  • 18-Norpregn-4-ene-3,20-dione, 21-hydroxy-13-(2-propynyl)-

Registry Numbers

CAS Registry Number

  • 80899-91-8

System Generated Number

  • 0080899918

Structure Descriptors

InChI

1S/C23H30O3/c1-3-10-23-12-9-18-17(19(23)6-7-20(23)21(26)14-24)5-4-15-13-16(25)8-11-22(15,18)2/h1,13,17-20,24H,4-12,14H2,2H3/t17-,18+,19+,20-,22+,23?/m1/s1

InChIKey

HEPLOTWQTPMDBG-XREPOJNXSA-N

Smiles

C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CCC4([C@H]3CC[C@@H]4C(=O)CO)CC#C