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Substance Name: Estradiol-17beta-glucuronide
RN: 1806-98-0
InChIKey: MTKNDAQYHASLID-RNFKDHMMSA-N

Molecular Weight

  • 448.509
 
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Names and Synonyms

Name of Substance

  • Estradiol-17beta-glucuronide

Synonyms

  • 17beta-Estradiol glucuronide
  • 17beta-Estradiol-17-(beta-D-glucuronide)
  • Estradiol-17beta-glucuronide
  • Oestradiol-17beta-glucuronide

Systematic Name

  • beta-D-Glucopyranosiduronic acid, (17beta)-3-hydroxyestra-1,3,5(10)-trien-17-yl

Registry Numbers

CAS Registry Number

  • 1806-98-0

System Generated Number

  • 0001806980

Structure Descriptors

InChI

1S/C24H32O8/c1-24-9-8-14-13-5-3-12(25)10-11(13)2-4-15(14)16(24)6-7-17(24)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-21,23,25-28H,2,4,6-9H2,1H3,(H,29,30)/t14?,15?,16?,17-,18-,19-,20+,21-,23+,24-/m0/s1

InChIKey

MTKNDAQYHASLID-RNFKDHMMSA-N

Smiles

O([C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)[C@H]1CC[C@@H]2[C@@H]3CCc4cc(ccc4[C@@H]3CC[C@@]12C)O