Exact Mass: 187.0643
Exact Mass Matches: 187.0643
Found 185 metabolites which its exact mass value is equals to given mass value 187.0643,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
6-Chloro-N-(1-methylethyl)-1,3,5-triazine-2,4-diamine
CONFIDENCE standard compound; INTERNAL_ID 1296; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7123; ORIGINAL_PRECURSOR_SCAN_NO 7121
CONFIDENCE standard compound; INTERNAL_ID 1296; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7114; ORIGINAL_PRECURSOR_SCAN_NO 7112
CONFIDENCE standard compound; INTERNAL_ID 1296; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7136; ORIGINAL_PRECURSOR_SCAN_NO 7132
CONFIDENCE standard compound; INTERNAL_ID 1296; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7127; ORIGINAL_PRECURSOR_SCAN_NO 7125
CONFIDENCE standard compound; INTERNAL_ID 1296; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7139; ORIGINAL_PRECURSOR_SCAN_NO 7137
CONFIDENCE standard compound; INTERNAL_ID 1296; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7129; ORIGINAL_PRECURSOR_SCAN_NO 7127
6-Chloro-N-(1-methylethyl)-1,3,5-triazine-2,4-diamine is a major soil metabolite of Atrazine
Indoleacrylic acid
Indoleacrylic acid (CAS: 1204-06-4), also known as indoleacrylate, IA, and IAcrA, is a member of the class of compounds known as indoles. Indoles are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole. Indoleacrylic acid is practically insoluble (in water) and a weak acidic compound (based on its pKa). Within the cell, indoleacrylic acid is primarily located in the membrane (predicted from logP). Indoleacrylic acid is best known as a plant growth hormone (a natural auxin), whereas its biological role in animals is still unknown. A two-stage production of this compound is likely: intestinal microorganisms catabolize tryptophan to indole derivatives which are then absorbed and converted into indoleacrylic acid and its glycine conjugate, indolylacryloylglycine (IAcrGly). Indolylacryloylglycine excretion in urine is especially pronounced in some myopathies, namely in boys with Duchenne muscular dystrophy (PMID: 10707769). It has been recently found that indoleacrylic acid promotes intestinal epithelial barrier function and mitigates inflammatory responses. Stimulating indoleacrylic acid production could promote anti-inflammatory responses and have therapeutic benefits (PMID: 28704649). Urinary Indole-3-acrylate is produced by Clostridium sporogenes (PMID: 29168502). Indoleacrylic acid is also a metabolite of Peptostreptococcus (PMID: 28704649, 29168502). trans-3-Indoleacrylic acid is an endogenous metabolite.
1-(2-Hydroxyethyl-2-hydroxymethyl)-5-nitro-imidazole
1-(2-Hydroxyethyl)-2-hydroxymethyl-5-nitroimidazole
9,9a-dihydro-naphtho[2,3-c]isoxazol-3(1H)-one|naphthisoxazol A
1-Acetylindole-3-carboxaldehyde
An N-acylindole that is N-acetylindole carrying an additional formyl substituent at position 3.
4-Methyl-[1,2]naphthochinon-2-oxim|4-methyl-[1,2]naphthoquinone-2-oxime
3-Indoleacrylic acid [M+H-H2O]+; AIF: CE10; MS2Dec
3-Indoleacrylic acid [M+H-H2O]+; AIF: CE30; MS2Dec
1-(2-Hydroxyethyl)-2-hydroxymethyl-5-nitroimidazole
8-Methyl-2-Oxo-1,2-Dihydro-Quinoline-3-Carbaldehyde
Cyclopropanamine, 1-(4-fluorophenyl)-, hydrochloride
6-Fluoro-1,2,3,4-tetrahydro-isoquinoline hydrochloride
1H-Imidazole-4-carboxylicacid,2-amino-4,5-dihydro-4-hydroxy-5-oxo-,ethyl
5-Fluoro-1,2,3,4-tetrahydro-isoquinoline hydrochloride
6-fluoro-2,3-dihydro-1H-inden-1-amine,hydrochloride
7-Fluoro-1,2,3,4-tetrahydro-isoquinoline hydrochloride
6-(CHLOROMETHYL)-N,N-DIMETHYL-1,3,5-TRIAZINE-2,4-DIAMINE
(2Z)-3-Thiomorpholinylideneacetic acid ethyl ester
(3-AMINO-4-METHYLPHENYL)BORONIC ACID HYDROCHLORIDE
Desmethylmisonidazole
C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent D011838 - Radiation-Sensitizing Agents D009676 - Noxae > D009153 - Mutagens
1,2-Dihydro-7-Methyl-2-Oxo-3-Quinolinecarboxaldehyde
5-FLUORO-1,2,3,4-TETRAHYDRO-QUINOLINE HYDROCHLORIDE
1-METHYL-2-OXO-1,2-DIHYDROQUINOLINE-3-CARBALDEHYDE
6-Methyl-2-oxo-1,2-dihydroquinoline-3-carbaldehyde
(1R,2S)-2-(4-fluorophenyl)cyclopropan-1-amine hydrochloride
N-acetyl-D-glutaminate
The conjugate base of N(2)-acetyl-D-glutamine; major species at pH 7.3.
Deethylatrazine
A chloro-1,3,5-triazine that is 6-chloro-1,3,5-triazine-2,4-diamine in which one of the hydrogens of the amino group is replaced by a propan-2-yl group.
N-acetyl-L-glutaminate
An N(2)-acetylglutaminate that has L-configuration; major species at pH 7.3.
