Estradiol 3,17-disulfate
CAS Registry Number®
3233-70-3
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CAS Name
Estradiol 3,17-disulfateMolecular Formula
C18H24O8S2Molecular Mass
432.51Cite this Page
Estradiol 3,17-disulfate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3233-70-3 (retrieved ) (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
