17β-Estradiol-3-(β-D-glucuronide) 17-sulfate

More details:

• Systematic name

  (17beta)-17-(Sulfooxy)estra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid

• SMILES

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

• Std. InChi

  InChI=1S/C24H32O11S/c1-24-9-8-14-13-5-3-12(33-23-20(27)18(25)19(26)21(34-23)22(28)29)10-11(13)2-4-15(14)16(24)6-7-17(24)35-36(30,31)32/h3,5,10,14-21,23,25-27H,2,4,6-9H2,1H3,(H,28,29)(H,30,31,32)/t14-,15-,16+,17+,18+,19+,20-,21+,23-,24+/m1/s1

• Std. InChIKey

  XZXBPAODZJETKT-QXYWQCSFSA-N

• Cite this record

  CSID:10128415, http://www.chemspider.com/Chemical-Structure.10128415.html (accessed 18:43, Apr 25, 2024)