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Substance Name: Estra-1,3,5(10),7-tetraene-3,17alpha-diol 17-acetate
RN: 58212-86-5
InChIKey: CCPTXKVXEUQMCP-MDNKFWRPSA-N

Molecular Formula

  • C20-H24-O3

Molecular Weight

  • 312.4066
 
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Names and Synonyms

Synonym

  • EINECS 261-168-0

Systematic Name

  • Estra-1,3,5(10),7-tetraene-3,17alpha-diol 17-acetate

Registry Numbers

CAS Registry Number

  • 58212-86-5

System Generated Number

  • 0058212865

Structure Descriptors

InChI

1S/C20H24O3/c1-12(21)23-19-8-7-18-17-5-3-13-11-14(22)4-6-15(13)16(17)9-10-20(18,19)2/h4-6,11,16,18-19,22H,3,7-10H2,1-2H3/t16-,18+,19-,20+/m1/s1

InChIKey

CCPTXKVXEUQMCP-MDNKFWRPSA-N

Smiles

CC(=O)O[C@@H]1CC[C@H]2C3=CCc4cc(O)ccc4[C@H]3CC[C@]12C