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Substance Name: Estriol 17-glucuronide
RN: 7219-89-8
InChIKey: CZGFLAQOJPXVRV-GITAKMRZSA-N

Molecular Formula

  • C24-H32-O9

Molecular Weight

  • 464.508
 
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Names and Synonyms

Name of Substance

  • Estriol 17-glucuronide

Systematic Name

  • beta-D-Glucopyranosiduronic acid, (16alpha,17beta)-3,16-dihydroxyestra-1,3,5(10)-trien-17-yl

Registry Numbers

CAS Registry Number

  • 7219-89-8

System Generated Number

  • 0007219898

Structure Descriptors

InChI

1S/C24H32O9/c1-24-7-6-13-12-5-3-11(25)8-10(12)2-4-14(13)15(24)9-16(26)21(24)33-23-19(29)17(27)18(28)20(32-23)22(30)31/h3,5,8,13-21,23,25-29H,2,4,6-7,9H2,1H3,(H,30,31)/t13-,14-,15+,16+,17-,18-,19+,20-,21-,23?,24-/m0/s1

InChIKey

CZGFLAQOJPXVRV-GITAKMRZSA-N

Smiles

c1(O)ccc2[C@@H]3CC[C@@]4([C@H]([C@@H](C[C@H]4[C@H]3CCc2c1)O)O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)C(=O)O)C