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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20O6S2.2K
Molecular Weight 474.674
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SYGETHIN

SMILES

[K+].[K+].CC[C@@H]([C@@H](CC)C1=CC=C(C=C1)S([O-])(=O)=O)C2=CC=C(C=C2)S([O-])(=O)=O

InChI

InChIKey=BLMUAVFFONATJG-ULEYXFCOSA-L
InChI=1S/C18H22O6S2.2K/c1-3-17(13-5-9-15(10-6-13)25(19,20)21)18(4-2)14-7-11-16(12-8-14)26(22,23)24;;/h5-12,17-18H,3-4H2,1-2H3,(H,19,20,21)(H,22,23,24);;/q;2*+1/p-2/t17-,18+;;

HIDE SMILES / InChI

Molecular Formula C18H20O6S2
Molecular Weight 396.478
Charge -2
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula K
Molecular Weight 39.0983
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 10:44:13 GMT 2023
Edited
by admin
on Sat Dec 16 10:44:13 GMT 2023
Record UNII
9T83V1MAEJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SYGETHIN
WHO-DD  
Common Name English
BENZENESULFONIC ACID, 4,4'-((1R,2S)-1,2-DIETHYL-1,2-ETHANEDIYL)BIS-, POTASSIUM SALT (1:2), REL-
Common Name English
SYGETIN
Brand Name English
Sygethin [WHO-DD]
Common Name English
BENZENESULFONIC ACID, 4,4'-((1R,2S)-1,2-DIETHYL-1,2-ETHANEDIYL)BIS-, DIPOTASSIUM SALT, REL-
Common Name English
DIPOTASSIUM 4,4'-((3R,4S)-HEXANE-3,4-DIYL)DIBENZENESULFONATE
Systematic Name English
SIGETIN
Brand Name English
BIBENZYL-4,4'-DISULFONIC ACID, .ALPHA.,.ALPHA.'-DIETHYL-, DIPOTASSIUM SALT, MESO-
Systematic Name English
SAGENIT
Brand Name English
BENZENESULFONIC ACID, 4,4'-(1,2-DIETHYL-1,2-ETHANEDIYL)BIS-, DIPOTASSIUM SALT, (R*,S*)-
Systematic Name English
Code System Code Type Description
PUBCHEM
15052966
Created by admin on Sat Dec 16 10:44:13 GMT 2023 , Edited by admin on Sat Dec 16 10:44:13 GMT 2023
PRIMARY
SMS_ID
100000176244
Created by admin on Sat Dec 16 10:44:13 GMT 2023 , Edited by admin on Sat Dec 16 10:44:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID50928902
Created by admin on Sat Dec 16 10:44:13 GMT 2023 , Edited by admin on Sat Dec 16 10:44:13 GMT 2023
PRIMARY
FDA UNII
9T83V1MAEJ
Created by admin on Sat Dec 16 10:44:13 GMT 2023 , Edited by admin on Sat Dec 16 10:44:13 GMT 2023
PRIMARY
CAS
13517-49-2
Created by admin on Sat Dec 16 10:44:13 GMT 2023 , Edited by admin on Sat Dec 16 10:44:13 GMT 2023
PRIMARY
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ACTIVE MOIETY