U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C18H18O8S2.2K
Molecular Weight 504.657
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DIETHYLSTILBESTROL DISULFATE DIPOTASSIUM

SMILES

[K+].[K+].CC\C(C1=CC=C(OS([O-])(=O)=O)C=C1)=C(\CC)C2=CC=C(OS([O-])(=O)=O)C=C2

InChI

InChIKey=WANVJYFCEIRGAT-QIKYXUGXSA-L
InChI=1S/C18H20O8S2.2K/c1-3-17(13-5-9-15(10-6-13)25-27(19,20)21)18(4-2)14-7-11-16(12-8-14)26-28(22,23)24;;/h5-12H,3-4H2,1-2H3,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2/b18-17+;;

HIDE SMILES / InChI

Approval Year

Name Type Language
DIETHYLSTILBESTROL DISULFATE DIPOTASSIUM
Systematic Name English
DIPOTASSIUM DIETHYLSTILBESTROL DISULFATE
Systematic Name English
4,4'-STILBENEDIOL, .ALPHA.,.ALPHA.'-DIETHYL-, BIS(HYDROGEN SULFATE) DIPOTASSIUM SALT, (E)-
Common Name English
POTASSIUM DIETHYLSTILBESTROL DISULFATE
Systematic Name English
PHENOL, 4,4'-(1,2-DIETHYL-1,2-ETHENEDIYL)BIS-, BIS(HYDROGEN SULFATE), DIPOTASSIUM SALT, (E)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80168859
Created by admin on Sat Dec 16 05:32:58 GMT 2023 , Edited by admin on Sat Dec 16 05:32:58 GMT 2023
PRIMARY
CAS
63020-94-0
Created by admin on Sat Dec 16 05:32:57 GMT 2023 , Edited by admin on Sat Dec 16 05:32:57 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
71587010
Created by admin on Sat Dec 16 05:32:58 GMT 2023 , Edited by admin on Sat Dec 16 05:32:58 GMT 2023
PRIMARY
CAS
17046-61-6
Created by admin on Sat Dec 16 05:32:57 GMT 2023 , Edited by admin on Sat Dec 16 05:32:57 GMT 2023
PRIMARY
FDA UNII
EXV825Z5QF
Created by admin on Sat Dec 16 05:32:58 GMT 2023 , Edited by admin on Sat Dec 16 05:32:58 GMT 2023
PRIMARY