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Details

Stereochemistry MIXED
Molecular Formula C17H29NO6S
Molecular Weight 375.48
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 5-HYDROXY SETHOXYDIM SULFONE

SMILES

CCC\C(=N/OCC)C1=C(O)CC(O)(CC(C)S(=O)(=O)CC)CC1=O

InChI

InChIKey=WFRYAKWUDQESGJ-QGOAFFKASA-N
InChI=1S/C17H29NO6S/c1-5-8-13(18-24-6-2)16-14(19)10-17(21,11-15(16)20)9-12(4)25(22,23)7-3/h12,19,21H,5-11H2,1-4H3/b18-13+

HIDE SMILES / InChI

Molecular Formula C17H29NO6S
Molecular Weight 375.48
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:36:23 GMT 2025
Edited
by admin
on Tue Apr 01 16:36:23 GMT 2025
Record UNII
J234Q84QI2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-HYDROXY SETHOXYDIM SULFONE
Common Name English
SETHOXYDIM 5-OH-MS02
Preferred Name English
Code System Code Type Description
CAS
106613-06-3
Created by admin on Tue Apr 01 16:36:23 GMT 2025 , Edited by admin on Tue Apr 01 16:36:23 GMT 2025
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EPA CompTox
DTXSID3037595
Created by admin on Tue Apr 01 16:36:23 GMT 2025 , Edited by admin on Tue Apr 01 16:36:23 GMT 2025
PRIMARY
FDA UNII
J234Q84QI2
Created by admin on Tue Apr 01 16:36:23 GMT 2025 , Edited by admin on Tue Apr 01 16:36:23 GMT 2025
PRIMARY
PUBCHEM
135665275
Created by admin on Tue Apr 01 16:36:23 GMT 2025 , Edited by admin on Tue Apr 01 16:36:23 GMT 2025
PRIMARY