Estriol 17-glucuronide
CAS Registry Number®
7219-89-8
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CAS Name
Estriol 17-glucuronideMolecular Formula
C24H32O9Molecular Mass
464.51Cite this Page
Estriol 17-glucuronide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=7219-89-8 (retrieved ) (CAS RN: 7219-89-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
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+/m1/s1
InChIKey
InChIKey=CZGFLAQOJPXVRV-FLVROIOLSA-N
SMILES
C[C@@]12[C@]([C@]3([C@](CC1)(C=4C(CC3)=CC(O)=CC4)[H])[H])(C[C@@H](O)[C@@H]2O[C@@H]5O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]5O)[H]
Canonical SMILES
O=C(O)C1OC(OC2C(O)CC3C4CCC5=CC(O)=CC=C5C4CCC23C)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranosiduronic acid, (16α,17β)-3,16-dihydroxyestra-1,3,5(10)-trien-17-yl
- Glucopyranosiduronic acid, 3,16α-dihydroxyestra-1,3,5(10)-trien-17β-yl, β-D-
- Estra-1,3,5(10)-triene-3,16α-diol, 17β-(β-D-glucopyranuronosyloxy)-
- (16α,17β)-3,16-Dihydroxyestra-1,3,5(10)-trien-17-yl β-D-glucopyranosiduronic acid
- Estriol 17β-monoglucuronide
Deleted or Replaced CAS Registry Numbers
30330-59-7
