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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18O8S2.2Na
Molecular Weight 472.44
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DIETHYLSTILBESTROL DISULFATE DISODIUM

SMILES

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

InChI

InChIKey=PHVIZNLHXORJTK-QIKYXUGXSA-L
InChI=1S/C18H20O8S2.2Na/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

Molecular Formula C18H18O8S2
Molecular Weight 426.461
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 04:55:52 GMT 2023
Edited
by admin
on Sat Dec 16 04:55:52 GMT 2023
Record UNII
1CCU66Q1YK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHYLSTILBESTROL DISULFATE DISODIUM
Systematic Name English
4,4'-STILBENEDIOL, .ALPHA.,.ALPHA.'-DIETHYL-, BIS(HYDROGEN SULFATE), DISODIUM SALT
Common Name English
NSC-74836
Code English
PHENOL, 4,4'-(1,2-DIETHYL-1,2-ETHENEDIYL)BIS-, BIS(HYDROGEN SULFATE)
Common Name English
IDROESTRIL DISODIUM SALT
Common Name English
Code System Code Type Description
NSC
74836
Created by admin on Sat Dec 16 04:55:52 GMT 2023 , Edited by admin on Sat Dec 16 04:55:52 GMT 2023
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PUBCHEM
71586782
Created by admin on Sat Dec 16 04:55:52 GMT 2023 , Edited by admin on Sat Dec 16 04:55:52 GMT 2023
PRIMARY
CAS
1553-21-5
Created by admin on Sat Dec 16 04:55:52 GMT 2023 , Edited by admin on Sat Dec 16 04:55:52 GMT 2023
PRIMARY
FDA UNII
1CCU66Q1YK
Created by admin on Sat Dec 16 04:55:52 GMT 2023 , Edited by admin on Sat Dec 16 04:55:52 GMT 2023
PRIMARY