Estradiol 3,17-disulfate

CAS Registry Number®

3233-70-3

CAS Name

Estradiol 3,17-disulfate

Molecular Formula

C18H24O8S2

Molecular Mass

432.51

Cite this Page

Estradiol 3,17-disulfate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3233-70-3 (retrieved 2024-11-21) (CAS RN: 3233-70-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H24O8S2/c1-18-9-8-14-13-5-3-12(25-27(19,20)21)10-11(13)2-4-15(14)16(18)6-7-17(18)26-28(22,23)24/h3,5,10,14-17H,2,4,6-9H2,1H3,(H,19,20,21)(H,22,23,24)/t14-,15-,16+,17+,18+/m1/s1

InChIKey

InChIKey=VPLAJGAMHNQZIY-ZBRFXRBCSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(OS(=O)(=O)O)=CC4)(CC1)[H])[H])(CC[C@@H]2OS(=O)(=O)O)[H]

Canonical SMILES

O=S(=O)(O)OC1=CC=C2C(=C1)CCC3C2CCC4(C)C(OS(=O)(=O)O)CCC34

Other Names for this Substance

  • Estra-1,3,5(10)-triene-3,17-diol (17β)-, 3,17-bis(hydrogen sulfate)
  • Estradiol, bis(hydrogen sulfate)
  • Estra-1,3,5(10)-triene-3,17-diol (17β)-, bis(hydrogen sulfate)
  • Estradiol disulfate
  • Estra-1,3,5(10)-trien-3,17β-ylene sulfate

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration