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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H16NO
Molecular Weight 118.1973
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of L-.BETA.-METHYLCHOLINE

SMILES

C[C@H](O)C[N+](C)(C)C

InChI

InChIKey=JPKKMFOXWKNEEN-LURJTMIESA-N
InChI=1S/C6H16NO/c1-6(8)5-7(2,3)4/h6,8H,5H2,1-4H3/q+1/t6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C6H15NO
Molecular Weight 117.1894
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:27:32 GMT 2023
Edited
by admin
on Sat Dec 16 18:27:32 GMT 2023
Record UNII
3568CR6O9S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-.BETA.-METHYLCHOLINE
Common Name English
1-PROPANAMINIUM, 2-HYDROXY-N,N,N-TRIMETHYL-, (S)-
Systematic Name English
AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-, L-
Systematic Name English
AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-, (+)-
Systematic Name English
.BETA.-METHYLCHOLINE, L-
Common Name English
Code System Code Type Description
FDA UNII
3568CR6O9S
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
CAS
28835-52-1
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
PUBCHEM
10410806
Created by admin on Sat Dec 16 18:27:32 GMT 2023 , Edited by admin on Sat Dec 16 18:27:32 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER