Sodium equilin sulfate
CAS Registry Number®
16680-47-0
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CAS Name
Sodium equilin sulfateMolecular Formula
C18H20O5S.NaCite this Page
Sodium equilin sulfate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=16680-47-0 (retrieved ) (CAS RN: 16680-47-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C18H20O5S.Na/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19;/h3-5,10,14,16H,2,6-9H2,1H3,(H,20,21,22);/t14-,16+,18+;/m1./s1
InChIKey
InChIKey=RMFRALSRVMTLBI-QWAPEVOJSA-N
SMILES
C[C@@]12[C@](C=3[C@@](C=4C(CC3)=CC(OS(=O)(=O)O)=CC4)(CC1)[H])(CCC2=O)[H].[Na]
Canonical SMILES
[Na].O=C1CCC2C3=CCC4=CC(OS(=O)(=O)O)=CC=C4C3CCC12C
Other Names for this Substance
- Estra-1,3,5(10),7-tetraen-17-one, 3-(sulfooxy)-, sodium salt (1:1)
- Estra-1,3,5(10),7-tetraen-17-one, 3-hydroxy-, hydrogen sulfate, sodium salt
- Estra-1,3,5(10),7-tetraen-17-one, 3-(sulfooxy)-, sodium salt
- Equilin, sulfate, sodium salt
- Sodium equilin sulfate
