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

Details

Stereochemistry ACHIRAL
Molecular Formula C3H9NO
Molecular Weight 75.1097
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIMETHYLAMINE OXIDE

SMILES

C[N+](C)(C)[O-]

InChI

InChIKey=UYPYRKYUKCHHIB-UHFFFAOYSA-N
InChI=1S/C3H9NO/c1-4(2,3)5/h1-3H3

HIDE SMILES / InChI

Molecular Formula C3H9NO
Molecular Weight 75.1097
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Potentiation of ferrous sulphate and ascorbate on the microbial transformation of endogenous trimethylamine N-oxide to trimethylamine and dimethylamine in squid extracts.
1989 Sep
Diagnosis of suspected trimethylaminuria by NMR spectroscopy.
2005 Jan
Trimethylamine and trimethylamine oxide levels in normal women and women with bacterial vaginosis reflect a local metabolism in vaginal secretion as compared to urine.
2005 Jul-Aug
Novel use of an osmolyte to dissect multiple thermodynamic linkages in a chemokine ligand-receptor system.
2005 Oct 4
Rapid screening assay of trimethylaminuria in urine with matrix-assisted laser desorption/ionization time-of-flight mass spectrometry.
2007
Trimethylamine oxide suppresses stress-induced alteration of organic anion transport in choroid plexus.
2007 Feb
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:12:26 GMT 2023
Edited
by admin
on Fri Dec 15 17:12:26 GMT 2023
Record UNII
FLD0K1SJ1A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIMETHYLAMINE OXIDE
FHFI   INCI  
INCI  
Official Name English
FEMA NO. 4245
Code English
N,N-DIMETHYLMETHANAMINE N-OXIDE
Systematic Name English
TMAO
Common Name English
TRIMETHYLAMINE N-OXIDE [MI]
Common Name English
TRIMETHYLAMINE OXIDE [FHFI]
Common Name English
NSC-408426
Code English
TRIMETHYLAMINE OXIDE [INCI]
Common Name English
TRIMETHYLAMINE N-OXIDE
MI  
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION TRIMETHYLAMINE OXIDE
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
LOINC 90360-9
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
Code System Code Type Description
MESH
C005855
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
ECHA (EC/EINECS)
214-675-6
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
WIKIPEDIA
TRIMETHYLAMINE N-OXIDE
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
CAS
1184-78-7
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
CHEBI
15724
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID8049678
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
NSC
408426
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
JECFA MONOGRAPH
1603
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
MERCK INDEX
m11151
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY Merck Index
PUBCHEM
1145
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
FDA UNII
FLD0K1SJ1A
Created by admin on Fri Dec 15 17:12:26 GMT 2023 , Edited by admin on Fri Dec 15 17:12:26 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
SOLVATE->ANHYDROUS
Related Record Type Details
PARENT -> METABOLITE
PARENT -> METABOLITE
Related Record Type Details
ACTIVE MOIETY