Exact Mass: 172.99690520000001
Exact Mass Matches: 172.99690520000001
Found 357 metabolites which its exact mass value is equals to given mass value 172.99690520000001
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Sulfanilic acid
CONFIDENCE standard compound; EAWAG_UCHEM_ID 652 KEIO_ID S073
Deisopropylatrazine
CONFIDENCE standard compound; INTERNAL_ID 140; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6172; ORIGINAL_PRECURSOR_SCAN_NO 6168 CONFIDENCE standard compound; INTERNAL_ID 140; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6175; ORIGINAL_PRECURSOR_SCAN_NO 6173 CONFIDENCE standard compound; INTERNAL_ID 140; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6181; ORIGINAL_PRECURSOR_SCAN_NO 6180 CONFIDENCE standard compound; INTERNAL_ID 140; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6202; ORIGINAL_PRECURSOR_SCAN_NO 6200 CONFIDENCE standard compound; INTERNAL_ID 140; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6192; ORIGINAL_PRECURSOR_SCAN_NO 6191 CONFIDENCE standard compound; EAWAG_UCHEM_ID 287 CONFIDENCE standard compound; INTERNAL_ID 2539 CONFIDENCE standard compound; INTERNAL_ID 3726 CONFIDENCE standard compound; INTERNAL_ID 4030 CONFIDENCE standard compound; INTERNAL_ID 8411 KEIO_ID A203
2-Aminobenzenesulfonic acid
2-Aminobenzenesulfonic acid is an endogenous metabolite.
Azaserine
A carboxylic ester resulting from the formal condensation of the carboxy group of diazoacetic acid with the alcoholic hydroxy group of L-serine. An antibiotic produced by a Streptomyces species. C471 - Enzyme Inhibitor > C2158 - Glutamine Amidotransferase Inhibitor D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents
Guanidino succinic acid
Guanidino succinic acid is soluble (in water) and a moderately acidic compound (based on its pKa). Guanidino succinic acid can be found in apple and loquat, which makes guanidino succinic acid a potential biomarker for the consumption of these food products.
2-chloro-trans-dienelactone
2-chloro-trans-dienelactone, also known as cis-2-chloro-4-carboxymethylenebut-2-en-1,4-olide, is a member of the class of compounds known as butenolides. Butenolides are dihydrofurans with a carbonyl group at the C2 carbon atom. 2-chloro-trans-dienelactone is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 2-chloro-trans-dienelactone can be found in a number of food items such as giant butterbur, soy bean, common persimmon, and salmonberry, which makes 2-chloro-trans-dienelactone a potential biomarker for the consumption of these food products.
trigonelline chloride
Trigonelline chloride is an alkaloid with potential antidiabetic activity that can be isolated from Trigonella foenum-graecum L or Leonurus artemisia. Trigonelline chloride is a potent Nrf2 inhibitor that blocks Nrf2-dependent proteasome activity, thereby enhancing apoptosis in pancreatic cancer cells. Trigonelline chloride also has anti-HSV-1, antibacterial, and antifungal activity, and induces ferroptosis. Trigonelline chloride is an alkaloid with potential antidiabetic activity that can be isolated from Trigonella foenum-graecum L or Leonurus artemisia. Trigonelline chloride is a potent Nrf2 inhibitor that blocks Nrf2-dependent proteasome activity, thereby enhancing apoptosis in pancreatic cancer cells. Trigonelline chloride also has anti-HSV-1, antibacterial, and antifungal activity, and induces ferroptosis.
Trigonelline
Trigonelline chloride is an alkaloid with potential antidiabetic activity that can be isolated from Trigonella foenum-graecum L or Leonurus artemisia. Trigonelline chloride is a potent Nrf2 inhibitor that blocks Nrf2-dependent proteasome activity, thereby enhancing apoptosis in pancreatic cancer cells. Trigonelline chloride also has anti-HSV-1, antibacterial, and antifungal activity, and induces ferroptosis. Trigonelline chloride is an alkaloid with potential antidiabetic activity that can be isolated from Trigonella foenum-graecum L or Leonurus artemisia. Trigonelline chloride is a potent Nrf2 inhibitor that blocks Nrf2-dependent proteasome activity, thereby enhancing apoptosis in pancreatic cancer cells. Trigonelline chloride also has anti-HSV-1, antibacterial, and antifungal activity, and induces ferroptosis.
Trigonelline
Trigonelline chloride is an alkaloid with potential antidiabetic activity that can be isolated from Trigonella foenum-graecum L or Leonurus artemisia. Trigonelline chloride is a potent Nrf2 inhibitor that blocks Nrf2-dependent proteasome activity, thereby enhancing apoptosis in pancreatic cancer cells. Trigonelline chloride also has anti-HSV-1, antibacterial, and antifungal activity, and induces ferroptosis. Trigonelline chloride is an alkaloid with potential antidiabetic activity that can be isolated from Trigonella foenum-graecum L or Leonurus artemisia. Trigonelline chloride is a potent Nrf2 inhibitor that blocks Nrf2-dependent proteasome activity, thereby enhancing apoptosis in pancreatic cancer cells. Trigonelline chloride also has anti-HSV-1, antibacterial, and antifungal activity, and induces ferroptosis.
ANILINE-2-SULFONATE
2-Aminobenzenesulfonic acid is an endogenous metabolite.
2-Aminobenzenesulfonic acid
2-Aminobenzenesulfonic acid is an endogenous metabolite.
Benzenemethanamine, 4-chloro-2-fluoro-a-methyl-, (aR)-
4-chloro-6-ethoxypyrimidin-2-amine
C6H8ClN3O (173.03558679999998)
1,3,5-Triazine-2,4-diamine,6-chloro-N2,N2-dimethyl-
1-(2-Chloro-5-fluoro-3-pyridinyl)ethanone
C7H5ClFNO (173.00436820000002)
1,5-Difluoro-2-methyl-3-nitro-benzene
C7H5F2NO2 (173.02883340000002)
1-(2,3-dihydro-4-methyl-2-thioxothiazol-5-yl)ethan-1-one
N-(3-FLUORO-2-CHLORO-PHENYL)-FORMAMIDE
C7H5ClFNO (173.00436820000002)
6-(Difluoromethyl)-2-pyridinecarboxylic Acid
C7H5F2NO2 (173.02883340000002)
1,2-benzisothiazol-3(2H)-one, sodium salt
C7H4NNaOS (172.99112939999998)
d,l-3-chloroalanine methyl ester hydrochloride
C4H9Cl2NO2 (173.00103140000002)
2,2-Difluoro-1,3-benzodioxol-5-amine
C7H5F2NO2 (173.02883340000002)
1,3-Difluoro-2-methyl-4-nitrobenzene
C7H5F2NO2 (173.02883340000002)
2-[(6-CHLORO-3-PYRIDAZINYL)AMINO]-1-ETHANOL
C6H8ClN3O (173.03558679999998)
1-oxidopyridin-1-ium-2-carboximidamide,hydrochloride
C6H8ClN3O (173.03558679999998)
2-ISOPROPYL-4-METHYL-PYRIMIDINE-5-CARBOXYLIC ACID
C6H8ClN3O (173.03558679999998)
2-(6-chloropyrazin-2-ylamino)ethanol
C6H8ClN3O (173.03558679999998)
PYRAZINE-2-CARBOXIMIDIC ACID METHYLESTER
C6H8ClN3O (173.03558679999998)
2-Amino-pyridine-3-carbaldehyde oxime hydrochloride
C6H8ClN3O (173.03558679999998)
2-[(2-chloropyrimidin-4-yl)amino]ethanol
C6H8ClN3O (173.03558679999998)
Tiazotic acid
C - Cardiovascular system > C01 - Cardiac therapy C78274 - Agent Affecting Cardiovascular System
beta-chloro-d-alanine hydrochloride
C4H9Cl2NO2 (173.00103140000002)
methyl 3,5-difluoropyridine-2-carboxylate
C7H5F2NO2 (173.02883340000002)
1,3-Difluoro-5-methyl-2-nitrobenzene
C7H5F2NO2 (173.02883340000002)
(4-METHYL-4 H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID
1,4-Difluoro-2-methyl-5-nitrobenzene
C7H5F2NO2 (173.02883340000002)
1,2-Difluoro-3-methyl-4-nitrobenzene
C7H5F2NO2 (173.02883340000002)
2,2-Difluoro-1,3-benzodioxol-4-amine
C7H5F2NO2 (173.02883340000002)
(alphaR)-3-Chloro-2-fluoro-alpha-MethylbenzeneMethanamine
3-Chloro-6-oxo-1,6-dihydro-pyridine-2-carboxylicacid
2-chloro-N-(1-methylpyrazol-3-yl)acetamide
C6H8ClN3O (173.03558679999998)
2-[(3-chloropyrazin-2-yl)amino]ethanol
C6H8ClN3O (173.03558679999998)
2-Amino-5-Chloropyrimidine-4-Carboxylic Acid Hydrochloride
2-Chloro-1-(5-fluoro-2-pyridyl)ethanone
C7H5ClFNO (173.00436820000002)
6-Bromo-2-(Methylthio)thieno[2,3-d]pyrimidin-4(3H)-one
4-Chloro-6-methoxy-2-methyl-5-pyrimidinamine
C6H8ClN3O (173.03558679999998)
2-(Difluoromethyl)pyridine-3-carboxylic acid
C7H5F2NO2 (173.02883340000002)
(4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid Methyl ester
Benzenemethanamine, 2-chloro-6-fluoro-a-methyl-, (aS)-
(2Z)-3-(5-Chloro-1H-1,2,4-triazol-3-yl)acrylic acid
5-oxo-3-sulfanylidene-2H-1,2,4-triazine-6-carboxylic acid
Methyl 3-chloroalaninate hydrochloride (1:1)
C4H9Cl2NO2 (173.00103140000002)
6-Chloro-2-ethoxypyrimidin-4-amine
C6H8ClN3O (173.03558679999998)
5-amino-1,2,3-thiadiazole-4-carboxylic acid ethyl ester
4-(2-hydroxyethylamino)-1,2,5-oxadiazole-3-carboxylic acid
1,2-Difluoro-4-methyl-5-nitrobenzene
C7H5F2NO2 (173.02883340000002)
Acetic acid,oxo(1,3,4-thiadiazol-2-ylamino)- (9CI)
2-chloro-5-[(methylthio)methyl]pyridine(SALTDATA: FREE)
1-(3-Amino-5-methyl-1H-pyrazol-1-yl)-2-chloroethanone
C6H8ClN3O (173.03558679999998)
2-chloro-trans-dienelactone
2-chloro-trans-dienelactone, also known as cis-2-chloro-4-carboxymethylenebut-2-en-1,4-olide, is a member of the class of compounds known as butenolides. Butenolides are dihydrofurans with a carbonyl group at the C2 carbon atom. 2-chloro-trans-dienelactone is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 2-chloro-trans-dienelactone can be found in a number of food items such as giant butterbur, soy bean, common persimmon, and salmonberry, which makes 2-chloro-trans-dienelactone a potential biomarker for the consumption of these food products.
N-Acetyl-L-aspartate
D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids
(3R,4S,5R)--3,4,5-trihydroxycyclohex-1-ene-1-carboxylate
cis-2-Chloro-4-carboxylatomethylenebut-2-en-1,4-olide
Phenyl sulfate
A phenyl sulfate oxoanion resulting from the removal of a proton from the hydrogen sulfate group of phenyl hydrogen sulfate. Major structure at pH 7.3
Dehydroascorbide(1-)
Conjugate base of dehydroascorbic acid arising from removal of the acidic proton at the C-2 position; major species at pH 7.3.
(2-Imino-3-methyl-5-oxoimidazolidin-4-yl) hydrogen carbonate
2-(Methyldithio)pyridine-N-oxide
A pyridine alkaloid that is pyridine N-oxide substituted by a methyldisulfanyl group at position 2. Isolated from Allium stipitatum, it exhibits antibacterial activity.
2-[(1S)-1,2-dihydroxyethyl]-3,4,5-trioxotetrahydrofuran-2-ide
(5S)-2,5-dihydroxy-5-(hydroxymethyl)-3-oxocyclohex-1-en-1-olate
(2S)-2-amino-3-[(Z)-2-diazonio-1-hydroxyethenoxy]propanoate
SULFANILIC ACID
An aminobenzenesulfonic acid that is aniline sulfonated at the para-position.
Deisopropylatrazine
A diamino-1,3,5-triazine that is N-ethyl-1,3,5-triazine-2,4-diamine substituted by a chloro group at position 6.
N-formyl-L-glutamate(2-)
A doubly-charged N-acyl-L-alpha-amino acid anion resulting from deprotonation of both carboxy groups of N-formyl-L-glutamic acid.
trans-2-Chloro-4-carboxylatomethylenebut-2-en-1,4-olide(1-)
L-Dehydroascorbate
An organic anion and the conjugate base of L-dehydroascorbic acid, arising from deprotonation of the acidic C2-position.
N-amidino-L-aspartate(2-)
A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of N-amidino-L-aspartic acid.
N-acetyl-L-aspartate(2-)
A doubly-charged N-acyl-L-alpha-amino acid anion resulting from deprotonation of both carboxy groups of N-acetyl-L-aspartic acid.