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Substance Name: Estradiol-3-glucuronide
RN: 15270-30-1
InChIKey: MUOHJTRCBBDUOW-QXYWQCSFSA-N

Molecular Weight

  • 448.5088
 
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Names and Synonyms

Name of Substance

  • Estradiol-3-glucuronide

Synonym

  • 17alpha-Estradiol-3-glucuronide

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 15270-30-1

System Generated Number

  • 0015270301

Structure Descriptors

InChI

1S/C24H32O8/c1-24-9-8-14-13-5-3-12(10-11(13)2-4-15(14)16(24)6-7-17(24)25)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+/m1/s1

InChIKey

MUOHJTRCBBDUOW-QXYWQCSFSA-N

Smiles

C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CC[C@@H]2O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O