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Substance Name: Estradiol-2,3-O-quinone
RN: 42261-16-5
InChIKey: LBSRSXWOMYPVBY-XSSYPUMDSA-N

Molecular Formula

  • C18-H22-O3

Molecular Weight

  • 286.369
 
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Names and Synonyms

Name of Substance

  • Estradiol-2,3-O-quinone

Synonym

  • Estradiol-2,3-quinone

Systematic Name

  • Estra-1(10),4-diene-2,3-dione, 17-hydroxy-, (17beta)-

Registry Numbers

CAS Registry Number

  • 42261-16-5

System Generated Number

  • 0042261165

Structure Descriptors

InChI

1S/C18H22O3/c1-18-7-6-11-12(14(18)4-5-17(18)21)3-2-10-8-15(19)16(20)9-13(10)11/h8-9,11-12,14,17,21H,2-7H2,1H3/t11-,12+,14-,17-,18-/m0/s1

InChIKey

LBSRSXWOMYPVBY-XSSYPUMDSA-N

Smiles

C1(C(C=C2CC[C@H]3[C@H]4[C@@](CC[C@H]3C2=C1)([C@H](CC4)O)C)=O)=O