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Details

Stereochemistry RACEMIC
Molecular Formula C12H19NO12S3
Molecular Weight 465.474
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TERBUTALINE TRI-O-SULFATE

SMILES

CC(C)(C)NCC(OS(O)(=O)=O)C1=CC(OS(O)(=O)=O)=CC(OS(O)(=O)=O)=C1

InChI

InChIKey=GIEHXBUAIYADEO-UHFFFAOYSA-N
InChI=1S/C12H19NO12S3/c1-12(2,3)13-7-11(25-28(20,21)22)8-4-9(23-26(14,15)16)6-10(5-8)24-27(17,18)19/h4-6,11,13H,7H2,1-3H3,(H,14,15,16)(H,17,18,19)(H,20,21,22)

HIDE SMILES / InChI

Molecular Formula C12H19NO12S3
Molecular Weight 465.474
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:58:58 GMT 2023
Edited
by admin
on Sat Dec 16 08:58:58 GMT 2023
Record UNII
LUE52L2793
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TERBUTALINE TRI-O-SULFATE
Common Name English
1,3-BENZENEDIOL, 5-(2-((1,1-DIMETHYLETHYL)AMINO)-1-(SULFOOXY)ETHYL)-, 1,3-BIS(HYDROGEN SULFATE)
Systematic Name English
Code System Code Type Description
PUBCHEM
91810667
Created by admin on Sat Dec 16 08:58:58 GMT 2023 , Edited by admin on Sat Dec 16 08:58:58 GMT 2023
PRIMARY
FDA UNII
LUE52L2793
Created by admin on Sat Dec 16 08:58:58 GMT 2023 , Edited by admin on Sat Dec 16 08:58:58 GMT 2023
PRIMARY
CAS
1273567-82-0
Created by admin on Sat Dec 16 08:58:58 GMT 2023 , Edited by admin on Sat Dec 16 08:58:58 GMT 2023
PRIMARY
Related Record Type Details
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URINE