Exact Mass: 303.0445
Exact Mass Matches: 303.0445
Found 195 metabolites which its exact mass value is equals to given mass value 303.0445,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
triallate
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3725 CONFIDENCE standard compound; INTERNAL_ID 2627 CONFIDENCE standard compound; INTERNAL_ID 8488 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
NORFLURAZON
D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4060; ORIGINAL_PRECURSOR_SCAN_NO 4056 ORIGINAL_ACQUISITION_NO 4060; CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 4056 DATA_PROCESSING MERGING RMBmix ver. 0.2.7; CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4018; ORIGINAL_PRECURSOR_SCAN_NO 4016 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8632; ORIGINAL_PRECURSOR_SCAN_NO 8629 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4018; ORIGINAL_PRECURSOR_SCAN_NO 4016 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8613; ORIGINAL_PRECURSOR_SCAN_NO 8609 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4026; ORIGINAL_PRECURSOR_SCAN_NO 4022 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8558; ORIGINAL_PRECURSOR_SCAN_NO 8555 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8639; ORIGINAL_PRECURSOR_SCAN_NO 8637 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4017; ORIGINAL_PRECURSOR_SCAN_NO 4015 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4023; ORIGINAL_PRECURSOR_SCAN_NO 4018 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8625; ORIGINAL_PRECURSOR_SCAN_NO 8623 CONFIDENCE standard compound; INTERNAL_ID 206; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8604; ORIGINAL_PRECURSOR_SCAN_NO 8602
Delphinidin
Delphinidin, also known as delphinidin chloride (CAS: 528-53-0), belongs to the class of organic compounds known as 7-hydroxyflavonoids. These are flavonoids that bear one hydroxyl group at the C-7 position of the flavonoid skeleton. Thus, delphinidin is considered to be a flavonoid lipid molecule. Delphinidin is found, on average, in the highest concentration within a few different foods, such as bilberries, cowpea, and blackcurrants, and in a lower concentration in common beans, common pea, and wheats. Delphinidin has also been detected, but not quantified in, several different foods, such as Brussel sprouts, fruits, horseradish tree, pepper (C. pubescens), and macadamia nuts. This could make delphinidin a potential biomarker for the consumption of these foods. Delphinidin is an anthocyanin and a primary plant pigment. Delphinidin gives blue hues to flowers like violas and delphiniums. It also gives the blue-red colour of the grape that produces Cabernet Sauvignon, and can be found in cranberries (Wikipedia). BioTransformer predicts that delphinidin is a product of 5,7-dihydroxy-3-{oxy}-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium metabolism via a glycoside-hydrolysis reaction occurring in human gut microbiota and catalyzed by an EC.3.2.1.X enzyme (PMID: 30612223). Widespread anthocyanidin found especies in blueberries, raspberries and red table wine. Glycosides also widespread. Delphinidin is found in many foods, some of which are macadamia nut (m. tetraphylla), oval-leaf huckleberry, napa cabbage, and sunburst squash (pattypan squash). 3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=13270-61-6 (retrieved 2024-09-18) (CAS RN: 13270-61-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Chlorambucil
A nitrogen mustard alkylating agent used as antineoplastic agent for the treatment of various malignant and nonmalignant diseases. Although it is less toxic than most other nitrogen mustards, it has been listed as a known carcinogen in the Fourth Annual Report on Carcinogens (NTP 85-002, 1985). (Merck Index, 11th ed) L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AA - Nitrogen mustard analogues D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D009676 - Noxae > D000477 - Alkylating Agents
Nedaplatin
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent > C1450 - Platinum Compound D000970 - Antineoplastic Agents Same as: D01416
2-(((3,5-Dichlorophenyl)carbamoyl)oxy)-2-methyl-3-butenoic acid
Clofarabine
Clofarabine is a purine nucleoside antimetabolite that is being studied in the treatment of cancer. It is marketed in the U.S. and Canada as Clolar. In Europe and Australia/New Zealand the product is marketed under the name Evoltra. Clofarabine is used in paediatrics to treat a type of leukaemia called relapsed or refractory acute lymphoblastic leukaemia (ALL), only after at least two other types of treatment have failed. It is not known if the drug extends life expectancy. Some investigations of effectiveness in cases of acute myeloid leukaemia (AML) and juvenile myelomonocytic leukaemia (JMML) have been carried out. L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BB - Purine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2150 - Ribonucleotide Reductase Inhibitor D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Clofarabine, a nucleoside analogue for research of cancer, is a potent inhibitor of ribonucleotide reductase (IC50=65 nM) by binding to the allosteric site on the regulatory subunit[1].
(2R)-1-(4-Iodophenyl)-N-propan-2-ylpropan-2-amine
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019275 - Radiopharmaceuticals
Leflutrozole
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C481 - Antiestrogen C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C1740 - Aromatase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist
(2S)-dihydrotricetin
(2s)-dihydrotricetin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (2s)-dihydrotricetin can be found in a number of food items such as towel gourd, roman camomile, asian pear, and cornmint, which makes (2s)-dihydrotricetin a potential biomarker for the consumption of these food products.
Delphinidin
An anthocyanidin cation consisting of benzopyrylium with hydroxy substituents at the 3-, 5- and 7-positions and a 3,4,5-trihydroxyphenyl group at the 2-position. It is a plant pigment responsible for the colours of the plants of the genera Viola and Delphinium.
4-chloro-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)benzamide
2-((2,4-Dihydroxybenzoyl)amino)-4-methoxybenzoic acid
2-thio-5-((methylamino)methyl)uridine|2-thio-5-<(methylamino)methyl>uridine|5-methylaminomethyl-2-thio-uridine|5-Methylaminomethyl-2-thiouridin|5-methylaminomethyl-2-thiouridine
Clofarabine
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BB - Purine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2150 - Ribonucleotide Reductase Inhibitor D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Clofarabine, a nucleoside analogue for research of cancer, is a potent inhibitor of ribonucleotide reductase (IC50=65 nM) by binding to the allosteric site on the regulatory subunit[1].
[(3-BROMO-4-FLUOROPHENYL)METHYL]-CARBAMIC ACID TERT-BUTYL ESTER
tert-Butyl 2,4-dichloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine-7-carboxylate
GPNA hydrochloride
GPNA hydrochloride is a well known substrate of the enzyme γ-glutamyltransferase (GGT). GPNA hydrochloride is a specific glutamine (Gln) transporter ASCT2 inhibitor. GPNA hydrochloride also inhibit Na+-dependent carriers, such as SNAT family (SNAT1/2/4/5), and the Na+-independent leucine transporters LAT1/2. GPNA reversibly induces apoptosis in A549 cells[1].
1-(5-(TRIFLUOROMETHYL)PYRIDIN-2-YL)PIPERAZINE DIHYDROCHLORIDE
tert-butyl 2,4-dichloro-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
3-CHLORO-4-(DIMETHYLCARBAMOYL)-[1,1-BIPHENYL]-4-CARBOXYLIC ACID
(4-Bromophenyl)(4-piperidinyl)methanone hydrochloride (1:1)
3,6-DIMETHOXY-5-NITRO-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
3-AMINO-3-(2-BROMO-4,5-DIMETHOXY-PHENYL)-PROPIONIC ACID
3-AMINO-3-(3-BROMO-4,5-DIMETHOXY-PHENYL)-PROPIONIC ACID
(4R,5R)-2-Chloro-3,4-dimethyl-2,5-diphenyl-1-oxa-3-aza-2-silacyclopentane
TERT-BUTYL 4-(BROMOMETHYL)-3-FLUOROPHENYLCARBAMATE
4-(2-AMINOMETHYL-MORPHOLIN-4-YLMETHYL)-BENZONITRILE DIHYDROCHLORIDE
1-[(2-chlorophenyl)methylamino]cyclohexane-1-carboxylic acid
1-[(4-chlorophenyl)methylamino]cyclohexane-1-carboxylic acid
1-[(3-chlorophenyl)methylamino]cyclohexane-1-carboxylic acid
1-(tert-Butyl) 2-methyl 4-bromo-1H-pyrrole-1,2-dicarboxylate
Ethyl 4-chloro-6-(trifluoromethyl)-3-quinolinecarboxylate
2-Anthracenesulfonicacid, 1-amino-9,10-dihydro-9,10-dioxo-
ETHYL 2-[BENZYLOXYCARBONYLIMINO]-3,3,3-TRIFLUORO-PROPIONATE
3-(4-CHLOROPHENYL)-2-(PHENYLSULFONYL)ACRYLONITRILE
Thiazolidine, 2-(2,5-dimethoxyphenyl)-3-(methylsulfonyl)- (9CI)
3-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyrimidine
3-[([[1-(4-CHLOROPHENYL)ETHYLIDENE]AMINO]OXY)METHYL]BENZOIC ACID
7-Hydroxycoumarin-3-carboxylic acid N-succinimidyl ester
2-BROMO-N-(2-(PYRROLIDIN-1-YL)ETHYL)THIAZOLE-4-CARBOXAMIDE
3-AMINO-3-(5-BROMO-2,4-DIMETHOXY-PHENYL)-PROPIONIC ACID
trimethyl-[[(2S,5S)-2-methyl-1,3-oxathiolan-5-yl]methyl]azanium,iodide
5-Bromo-1-(1,1-dimethylethyl)-1H-pyrrole-1,2-dicarboxylic acid 2-methyl ester
4-Chloro-7-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester
1H-PYRROLO[2,3-B]PYRIDINE, 5-NITRO-1-(PHENYLSULFONYL)-
4-Chloro-8-(trifluoromethyl)quinoline-3-carboxylicethylester
6-(1,3-Benzothiazol-2-yl)-4-oxo-1,4-dihydro-3-quinolinecarbonitri le
Potassium 4-(phenylaminocarbonyl)phenyltrifluoroborate
3-Iodo-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Benzyl 3-(chlorosulfonyl)pyrrolidine-1-carboxylate
1-(2-(2-FLUORO-4-(TRIFLUOROMETHYL)PHENYL)-4-METHYLTHIAZOL-5-YL)ETHANONE
5-Bromo-2-(2-(tert-Butoxy)ethoxy)-3-methoxypyridine
3-Acetylmethyl-1-benzyloxy-2-fluoro-4-nitrobenzene
2-(5-CARBOXYFURFURYLTHIO)-5-(TRIFLUOROMETHYL)PYRIDINE
4-(3,4-dichlorophenyl)-N-methyl-3,4-dihydro-2H-naphthalen-1-imine
4-(2-chlorophenyl)-2-methyl-5-oxo-7H-furo[3,4-b]pyridine-3-carboxylic acid
d-(-)-a-4-hydroxyphenylglycine dane salt methyl potassium
4-[(DIPROPYLAMINO)SULFONYL]BENZENE-1-CARBONYL CHLORIDE
4-[3,5-bis(trifluoromethyl)phenyl]-3-thiosemicarbazide
methyl 1-(3-benzoylthioureido)-1H-pyrrole-2-carboxylate
ETHYL 2-ISOTHIOCYANATO-5-METHYL-4-PHENYLTHIOPHENE-3-CARBOXYLATE
Benzonitrile,4-[(2-amino-5-bromo-6-methyl-4-pyrimidinyl)amino]-
Benzenemethanamine,N-(2-bromoethyl)-N- (phenylmethyl)-
7,7-dimethyl-3-[(4-methyl-1,3-thiazol-5-yl)methyl]-6,8-dihydrochromene-2,5-dione
n-hydroxy-4-(4-methoxyphenoxy)-3-nitrobenzenecarboximidamide
Iofetamine (123I)
V - Various > V09 - Diagnostic radiopharmaceuticals > V09A - Central nervous system > V09AB - Iodine (123i) compounds D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019275 - Radiopharmaceuticals C1446 - Radiopharmaceutical Compound
Glyclopyramide
C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C97936 - Sulfonylurea Antidiabetic Agent
5-[hydroxy-(4-nitrophenoxy)phosphoryl]pentanoic Acid
2-chloro-N-phenyl-N-[(phenylcarbamoyl)amino]acetamide
5-(6-Amino-2-chloro-9-purinyl)-4-fluoro-2-(hydroxymethyl)-3-oxolanol
2-[(4-aminophenyl)sulfanyl]-N-(3-nitrophenyl)acetamide
N-(3-chloro-4-methylphenyl)-2-(2-formylphenoxy)acetamide
2-Chloro-3-pyridinecarboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester
4-(beta-D-ribofuranosyl)aminobenzene 5-phosphate(2-)
(+)-Taxifolin(1-)
A flavonoid oxoanion that is the conjugate base of (+)-taxifolin, arising from selective deprotonation of the 7-hydroxy group; major species at pH 7.3.
(S)-4-(3-acetyl-5-hydroxy-4-oxo-1,4-dihydronapthalen-2-yl)-3-hydroxybutanoate
22-[(1R,3S)-5,9,10-trihydroxy-1-methyl-1H,3H,4H-naphtho[2,3-c]pyran-3-yl]acetate
2-((1R,3S),-1,9-dihydroxy-1-methyl-10-oxo-3,4,5,10-tetrahydro-1H-benzo[g]isochromen-3-yl)acetate
(+)-Epitaxifolin(1-)
The conjugate base of (+)-epitaxifolin arising from selective deprotonation of the 7-OH group; major species at pH 7.3.
3-[5-(azaniumylmethyl)-2-bromo-4-(carboxylatomethyl)-1H-pyrrol-3-yl]propanoate
7-Hydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-2,3-dihydrochromen-5-olate
6-Thiophen-2-yl-6,12-dihydrobenzimidazolo[1,2-c]quinazoline
2-(4-Chlorophenyl)-5-(2-oxolanylmethylamino)-4-oxazolecarbonitrile
N-[(E)-[2-(Difluoromethoxy)phenyl]methylideneamino]-1,3-benzoxazol-2-amine
3-Chloro-4-[(1-ethyl-2-benzimidazolyl)thio]aniline
4-Bromo-6-[[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]methylidene]-1-cyclohexa-2,4-dienone
2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)-N-[3-(trifluoromethyl)phenyl]acetamide
4-Acetamidobenzoic acid (2-chlorophenyl)methyl ester
(E)-1-(2-furyl)ethylidene-[2-methylimino-4-(2-thienyl)-4-thiazolin-3-yl]amine
2-[(1-methyl-3-indolyl)thio]-N-(2-thiazolyl)acetamide
2,4-Dimethyl-6-oxo-3-pyrancarboxylic acid (3-nitrophenyl)methyl ester
2-[[4-(1-Pyrrolidinylsulfonyl)phenyl]hydrazinylidene]propanedinitrile
3-(2-Chloroanilino)-3-methylsulanyl-1-phenylprop-2-en-1-one
chlorambucil
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AA - Nitrogen mustard analogues D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D009676 - Noxae > D000477 - Alkylating Agents
