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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H16NOS
Molecular Weight 162.273
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of ACETYLTHIOCHOLINE

SMILES

CC(=O)SCC[N+](C)(C)C

InChI

InChIKey=GFFIJCYHQYHUHB-UHFFFAOYSA-N
InChI=1S/C7H16NOS/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1

HIDE SMILES / InChI

Molecular Formula C7H16NOS
Molecular Weight 162.273
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 16:59:44 GMT 2023
Edited
by admin
on Sat Dec 16 16:59:44 GMT 2023
Record UNII
4V9VG6MX6E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETYLTHIOCHOLINE
Common Name English
AMMONIUM, (2-MERCAPTOETHYL)TRIMETHYL-, ACETATE (ESTER)
Systematic Name English
AMMONIUM, (2-MERCAPTOETHYL)TRIMETHYL-, ACETATE
Systematic Name English
2-(ACETYLTHIO)-N,N,N-TRIMETHYLETHANAMINIUM
Systematic Name English
Ethanaminium, 2-(acetylthio)-N,N,N-trimethyl-
Systematic Name English
ACETIC ACID, THIO-, S-ESTER WITH (2-MERCAPTOETHYL)TRIMETHYL AMMONIUM
Common Name English
(2-ACETYLSULFANYL-ETHYL)-TRIMETHYL-AMMONIUM
Systematic Name English
Code System Code Type Description
FDA UNII
4V9VG6MX6E
Created by admin on Sat Dec 16 16:59:44 GMT 2023 , Edited by admin on Sat Dec 16 16:59:44 GMT 2023
PRIMARY
WIKIPEDIA
Acetylthiocholine
Created by admin on Sat Dec 16 16:59:44 GMT 2023 , Edited by admin on Sat Dec 16 16:59:44 GMT 2023
PRIMARY
PUBCHEM
20544
Created by admin on Sat Dec 16 16:59:44 GMT 2023 , Edited by admin on Sat Dec 16 16:59:44 GMT 2023
PRIMARY
CAS
4468-05-7
Created by admin on Sat Dec 16 16:59:44 GMT 2023 , Edited by admin on Sat Dec 16 16:59:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID90196269
Created by admin on Sat Dec 16 16:59:44 GMT 2023 , Edited by admin on Sat Dec 16 16:59:44 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> SUBSTRATE
SALT/SOLVATE -> PARENT