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Substance Name: EBCO
RN: 28200-94-4
InChIKey: DOFNLZKUGHVIMH-UQWKGHMASA-N

Molecular Formula

  • C33-H40-O3

Molecular Weight

  • 484.676
 
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Names and Synonyms

Name of Substance

  • EBCO

Synonym

  • Estradiol 3-benzoate 17-cyclooctenyl ether

Systematic Name

  • Estra-1,3,5(10)-trien-3-ol, 17-(1-cycloocten-1-yloxy)-, benzoate, (17beta)-

Registry Numbers

CAS Registry Number

  • 28200-94-4

System Generated Number

  • 0028200944

Structure Descriptors

InChI

1S/C33H40O3/c1-33-21-20-28-27-17-15-26(36-32(34)23-10-6-5-7-11-23)22-24(27)14-16-29(28)30(33)18-19-31(33)35-25-12-8-3-2-4-9-13-25/h5-7,10-12,15,17,22,28-31H,2-4,8-9,13-14,16,18-21H2,1H3/b25-12+/t28-,29-,30+,31+,33+/m1/s1

InChIKey

DOFNLZKUGHVIMH-UQWKGHMASA-N

Smiles

C1(=CCCCCCC1)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(ccc4[C@H]3CC[C@@]12C)OC(=O)c1ccccc1