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Details

Stereochemistry ACHIRAL
Molecular Formula C9H20NO2.Cl
Molecular Weight 209.714
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Butyrylcholine chloride

SMILES

[Cl-].CCCC(=O)OCC[N+](C)(C)C

InChI

InChIKey=VCOBYGVZILHVOO-UHFFFAOYSA-M
InChI=1S/C9H20NO2.ClH/c1-5-6-9(11)12-8-7-10(2,3)4;/h5-8H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C9H20NO2
Molecular Weight 174.2606
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

PubMed

PubMed

TitleDatePubMed
Acetylcholinesterase and butyrylcholinesterase activities in obese Beagle dogs before and after weight loss.
2013 Jun
IN VITRO ACETYLCHOLINESTERASE AND BUTYRYLCHOLINESTERASE INHIBITORY POTENTIALS OF JATROPHA GOSSYPIFOLIA PLANT EXTRACTS.
2016 Mar-Apr
Substance Class Chemical
Created
by admin
on Sat Dec 16 12:50:05 GMT 2023
Edited
by admin
on Sat Dec 16 12:50:05 GMT 2023
Record UNII
HA8BW33DQF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Butyrylcholine chloride
Common Name English
2-Butyryloxyethyltrimethylammonium chloride
Systematic Name English
NSC-70378
Code English
Ethanaminium, N,N,N-trimethyl-2-(1-oxobutoxy)-, chloride
Common Name English
Ethanaminium, N,N,N-trimethyl-2-(1-oxobutoxy)-, chloride (1:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40952094
Created by admin on Sat Dec 16 12:50:05 GMT 2023 , Edited by admin on Sat Dec 16 12:50:05 GMT 2023
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NSC
70378
Created by admin on Sat Dec 16 12:50:05 GMT 2023 , Edited by admin on Sat Dec 16 12:50:05 GMT 2023
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CAS
2963-78-2
Created by admin on Sat Dec 16 12:50:05 GMT 2023 , Edited by admin on Sat Dec 16 12:50:05 GMT 2023
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FDA UNII
HA8BW33DQF
Created by admin on Sat Dec 16 12:50:05 GMT 2023 , Edited by admin on Sat Dec 16 12:50:05 GMT 2023
PRIMARY
ECHA (EC/EINECS)
220-999-9
Created by admin on Sat Dec 16 12:50:05 GMT 2023 , Edited by admin on Sat Dec 16 12:50:05 GMT 2023
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PUBCHEM
76297
Created by admin on Sat Dec 16 12:50:05 GMT 2023 , Edited by admin on Sat Dec 16 12:50:05 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE