Exact Mass: 246.061609
Exact Mass Matches: 246.061609
Found 179 metabolites which its exact mass value is equals to given mass value 246.061609,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Isopimpinellin
Isopimpinellin is a member of psoralens. Isopimpinellin is a natural product found in Zanthoxylum mayu, Zanthoxylum ovalifolium, and other organisms with data available. Isopimpinellin is found in angelica. Isopimpinellin is present in the seeds of Pastinaca sativa (parsnip) Isopimpinellin belongs to the family of Furanocoumarins. These are polycyclic aromatic compounds containing a furan ring fused to a coumarin moeity. See also: Angelica keiskei top (part of). Present in the seeds of Pastinaca sativa (parsnip). Isopimpinellin is found in many foods, some of which are carrot, anise, celery stalks, and fennel. Isopimpinellin is found in angelica. Isopimpinellin is present in the seeds of Pastinaca sativa (parsnip D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Isopimpinellin, an orally active compound isolated from Glomerella cingulata. Isopimpinellin blocks DNA adduct formation and skin tumor initiation by 7,12-dimethylbenz[a]anthracene. Isopimpinellin possesses anti-leishmania effect[1]. Isopimpinellin, an orally active compound isolated from Glomerella cingulata. Isopimpinellin blocks DNA adduct formation and skin tumor initiation by 7,12-dimethylbenz[a]anthracene. Isopimpinellin possesses anti-leishmania effect[1].
Pimpinellidine
Pimpinellin is a furanocoumarin. Pimpinellin is a natural product found in Dorstenia psilurus, Clausena anisata, and other organisms with data available. Pimpinellin is a furocoumarin. Furocoumarins, are phototoxic and photocarcinogenic. They intercalate DNA and photochemically induce mutations. Furocoumarins are botanical phytoalexins found to varying extents in a variety of vegetables and fruits, notably citrus fruits. The levels of furocoumarins present in our diets, while normally well below that causing evident acute phototoxicity, do cause pharmacologically relevant drug interactions. Some are particularly active against cytochrome P450s. For example, in humans, bergamottin and dihydroxybergamottin are responsible for the grapefruit juice effect, in which these furanocoumarins affect the metabolism of certain drugs. Aglycone from hydrolysis of leaves and stems of Lycopersicon pimpinellifolium (currant tomato). Pimpinellidine is found in garden tomato. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Pimpinellin is a constituent of Cyrtomium fortumei (J.). Pimpinellin inhibits the growth of tumor cells via the induction of tumor cell apoptosis[1]. Pimpinellin is a constituent of Cyrtomium fortumei (J.). Pimpinellin inhibits the growth of tumor cells via the induction of tumor cell apoptosis[1].
Floxuridine
C9H11FN2O5 (246.06519680000002)
An antineoplastic antimetabolite that is metabolized to fluorouracil when administered by rapid injection. Floxuridine is available as a sterile, nonpyrogenic, lyophilized powder for reconstitution. When administered by slow, continuous, intra-arterial infusion, it is converted to floxuridine monophosphate. It has been used to treat hepatic metastases of gastrointestinal adenocarcinomas and for palliation in malignant neoplasms of the liver and gastrointestinal tract. [PubChem] L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BC - Pyrimidine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Floxuridine (5-Fluorouracil 2'-deoxyriboside) is a?pyrimidine?analog?and known as an?oncology antimetabolite. Floxuridine inhibits Poly(ADP-Ribose) polymerase and induces DNA damage by activating the ATM and ATR checkpoint signaling pathways in vitro. Floxuridine is a extreamly potent inhibitor for S. aureus infection and induces cell apoptosis[1][2]. Floxuridine has antiviral effects against HSV and CMV[3].
5'-Deoxy-5-fluorouridine
C9H11FN2O5 (246.06519680000002)
5-Deoxy-5-fluorouridine is a metabolite of capecitabine. Capecitabine (Xeloda, Roche) is an orally-administered chemotherapeutic agent used in the treatment of metastatic breast and colorectal cancers. Capecitabine is a prodrug, that is enzymatically converted to 5-fluorouracil in the tumor, where it inhibits DNA synthesis and slows growth of tumor tissue. (Wikipedia) D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D019167 - Appetite Stimulants C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Same as: D01309 Doxifluridine has anticancer activity. Doxifluidine is a 5-FU prodrug. Doxifluridine is a thymidine synthase inhibitor. Doxifluridine can enhance tumor inhibition by synergizing with a variety of drugs[1][2][3].
Dibenzyl disulfide
Dibenzyl disulfide is an organic disulfide that results from the formal oxidative dimerisation of benzyl thiol. It has a role as a metabolite. It is an organic disulfide and an organic aromatic compound. Dibenzyl disulfide is a natural product found in Petiveria alliacea with data available. An organic disulfide that results from the formal oxidative dimerisation of benzyl thiol. Dibenzyl disulfide is a flavouring ingredien Flavouring ingredient Dibenzyl disulfide is an endogenous metabolite.
Coriandrone C
Constituent of Coriandrum sativum (coriander). Coriandrone C is found in coriander and herbs and spices. Coriandrone C is found in coriander. Coriandrone C is a constituent of Coriandrum sativum (coriander).
1-(3,4-Dihydroxy-5-methyl-2-oxolanyl)-5-fluoropyrimidine-2,4-dione
C9H11FN2O5 (246.06519680000002)
5-Fluoro-1-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
C9H11FN2O5 (246.06519680000002)
5'-Deoxy-5'-fluorouridine
C9H11FN2O5 (246.06519680000002)
9-Deaza-9-(3-thienylmethyl)guanine
Iriflophenone
Iriflophenone, isolated from Aquilaria sinensis, stimulates MCF-7 and T-47D human breast cancer cells proliferation[1][2]. Iriflophenone, isolated from Aquilaria sinensis, stimulates MCF-7 and T-47D human breast cancer cells proliferation[1][2].
2,2,4,4-Tetrahydroxybenzophenone
CONFIDENCE standard compound; INTERNAL_ID 1000; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3571; ORIGINAL_PRECURSOR_SCAN_NO 3569 CONFIDENCE standard compound; INTERNAL_ID 1000; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3562; ORIGINAL_PRECURSOR_SCAN_NO 3559 CONFIDENCE standard compound; INTERNAL_ID 1000; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3550; ORIGINAL_PRECURSOR_SCAN_NO 3546 CONFIDENCE standard compound; INTERNAL_ID 1000; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3558; ORIGINAL_PRECURSOR_SCAN_NO 3554 CONFIDENCE standard compound; INTERNAL_ID 1000; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3569; ORIGINAL_PRECURSOR_SCAN_NO 3564 CONFIDENCE standard compound; INTERNAL_ID 1000; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3561; ORIGINAL_PRECURSOR_SCAN_NO 3557 CONFIDENCE standard compound; INTERNAL_ID 8331
(S)-4-(4-hydroxyphenyl)-2-butanol 2-O-sulfate
C10H14O5S (246.05619140000002)
2,4-Dihydroxy-5-carboxy-dibenyl ether|2,4-dihydroxy-5-carboxydiphenyl ether
2-amino-N-(2-chlorophenyl)benzamide
C13H11ClN2O (246.05598659999998)
Iriflophenone
Iriflophenone is a natural product found in Iris potaninii, Aquilaria sinensis, and Iris domestica with data available. D007155 - Immunologic Factors > D000373 - Agglutinins > D037121 - Plant Lectins D007155 - Immunologic Factors > D000373 - Agglutinins > D037102 - Lectins Iriflophenone, isolated from Aquilaria sinensis, stimulates MCF-7 and T-47D human breast cancer cells proliferation[1][2]. Iriflophenone, isolated from Aquilaria sinensis, stimulates MCF-7 and T-47D human breast cancer cells proliferation[1][2].
bis-(4-hydroxybenzyl)sulfide
An organic sulfide that consists of two 4-hydroxybenzyl groups covalently bound to a central sulfur atom. It is isolated from Gastrodia elata and Pleuropterus ciliinervis and exhibits neoroprotective activity.
6-[2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-pyranone
methyl 7-formyl-2,5-dihydro-5-oxo-1-benzoxepine-3-carboxylate
8-(2-Thienyl)-3t,5t-octadien-7-in-1-ol-acetat|Ac-(3E,5E)-8-(2-Thienyl)-3,5-octadien-7-yl-1-ol
5,8-dimethoxypsoralen|isopimpinellin|isopinpinellin
1-Benzoyl-3-Hydroxy-2-(hydroxymethyl)-4H-Pyran-4-one
(3-hydroxyphenyl)-(2,4,6-trihydroxyphenyl)methanone
Isopimpinellin
Isopimpinellin, an orally active compound isolated from Glomerella cingulata. Isopimpinellin blocks DNA adduct formation and skin tumor initiation by 7,12-dimethylbenz[a]anthracene. Isopimpinellin possesses anti-leishmania effect[1]. Isopimpinellin, an orally active compound isolated from Glomerella cingulata. Isopimpinellin blocks DNA adduct formation and skin tumor initiation by 7,12-dimethylbenz[a]anthracene. Isopimpinellin possesses anti-leishmania effect[1].
4,9-dimethoxyfuro[3,2-g]chromen-7-one [IIN-based: Match]
4,9-dimethoxyfuro[3,2-g]chromen-7-one [IIN-based on: CCMSLIB00000847638]
Benzyldisulfide
Dibenzyl disulfide is an endogenous metabolite.
HISPIDIN
Fungal metabolite first found in basidiomycete Inonotus hispidus (formerly Polyporus hispidus). Hispidin, a PKC inhibitor and a phenolic compound from Phellinus linteus, has been shown to possess strong anti-oxidant, anti-cancer, anti-diabetic, and anti-dementia properties[1].
2-amino-5-chlorobenzophenone oxime
C13H11ClN2O (246.05598659999998)
n-(4-aminophenyl)-3-chlorobenzamide
C13H11ClN2O (246.05598659999998)
3-(4-FLUOROPHENYL)PIPERIDINE HYDROCHLORIDE
C13H11ClN2O (246.05598659999998)
3-[(3-fluorobenzyl)oxy]benzoic acid
C14H11FO3 (246.06921880000002)
1-Isoquinolinecarbonitrile,2-(3-chloro-1-oxopropyl)-1,2-dihydro-
C13H11ClN2O (246.05598659999998)
5-(2,3-DIHYDRO-BENZO[1,4]DIOXIN-6-YL)-2H-PYRAZOLE-3-CARBOXYLIC ACID
1-(4-Chlorobenzyl)piperazine hydrochloride
C11H16Cl2N2 (246.06904759999998)
2-[(3-Fluorophenoxy)methyl]benzoic acid
C14H11FO3 (246.06921880000002)
2-Amino-9(10H)-acridinone hydrochloride (1:1)
C13H11ClN2O (246.05598659999998)
METHYL 5,6-DIHYDROXY-2-PHENYLPYRIMIDINE-4-CARBOXYLATE
3-(ISOINDOLIN-2-YL)PROPAN-1-AMINE DIHYDROCHLORIDE
C11H16Cl2N2 (246.06904759999998)
5-(3-Methoxycarbonylphenyl)-furan-2-carboxylic acid
3-FLUORO-4-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
2-(4-Fluorophenyl)-1-(2,4-dihydroxyphenyl)ethanone
C14H11FO3 (246.06921880000002)
Acetamide,N-(6-amino-1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)-2-chloro-
N-BOC-2-CHLORO-4-FLUORO-5-PYRIDINAMINE
C10H12ClFN2O2 (246.05712939999998)
2-FLUORO-5-METHOXY-[1,1-BIPHENYL]-4-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
5-FLUORO-2-METHOXY-[1,1-BIPHENYL]-4-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
2-(1,3-benzodioxol-5-yl)-5-methyl-1H-imidazole-4-carboxylic acid
2-Deoxy-2-fluorouridine
C9H11FN2O5 (246.06519680000002)
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D006133 - Growth Substances > D006131 - Growth Inhibitors 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)uracil is a purine nucleoside analogue. Purine nucleoside analogs have broad antitumor activity targeting indolent lymphoid malignancies. Anticancer mechanisms in this process rely on inhibition of DNA synthesis, induction of apoptosis, etc[1]. 2'-Deoxy-2'-fluorouridine can be used as an intermediate for antiinfluenza virus agents synthesis[1].
6-chloro-7-methoxy-1-methyl-9H-pyrido[3,4-b]indole
C13H11ClN2O (246.05598659999998)
8-chloro-7-methoxy-1-methyl-9H-pyrido[3,4-b]indole
C13H11ClN2O (246.05598659999998)
4-prop-2-enyl-2,3-dihydro-1H-quinoxaline
C11H16Cl2N2 (246.06904759999998)
2-BENZYL-5,6-DIHYDROXY-PYRIMIDINE-4-CARBOXYLIC ACID
4-(4-hydroxy-2-methylphenyl)sulfanyl-3-methylphenol
[(2S)-2,3-dihydroxypropyl] 4-methylbenzenesulfonate
C10H14O5S (246.05619140000002)
3-FLUORO-5-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
4-FLUORO-3-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
N-(4-Aminophenyl)-4-chlorobenzamide
C13H11ClN2O (246.05598659999998)
2-(4-FLUORO-BENZYLOXY)-BENZOIC ACID
C14H11FO3 (246.06921880000002)
2-Amino-N-(3-chlorophenyl)benzamide
C13H11ClN2O (246.05598659999998)
4-FLUORO-2-HYDROXY-4-METHOXYBENZOPHENONE
C14H11FO3 (246.06921880000002)
4-Amino-N-(2-chlorophenyl)benzamide
C13H11ClN2O (246.05598659999998)
N-(Piperidin-4-yl)thiophene-2-carboxamide hydrochloride
C10H15ClN2OS (246.05935699999998)
2-Fluoro-5-methoxybiphenyl-3-carboxylic acid
C14H11FO3 (246.06921880000002)
2-FLUORO-3-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
3,4-DIMETHOXYPHENYLSULFONYLETHANOL
C10H14O5S (246.05619140000002)
2-Fluoro-4-methoxybiphenyl-3-carboxylic acid
C14H11FO3 (246.06921880000002)
3-amino-4-chloro-N-phenylbenzamide
C13H11ClN2O (246.05598659999998)
4-[(3-FLUOROBENZYL)OXY]BENZENECARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
4-[(2-Fluorobenzyl)oxy]benzoic acid
C14H11FO3 (246.06921880000002)
Mafenide Acetate
D004791 - Enzyme Inhibitors > D002257 - Carbonic Anhydrase Inhibitors C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents
2-[4-(4-fluorophenoxy)phenyl]acetic acid
C14H11FO3 (246.06921880000002)
5-TERT-BUTYL-2-METHOXY-BENZENESULFONYL CHLORIDE
C13H11ClN2O (246.05598659999998)
2-(BENZYLOXY)-4-FLUOROBENZOIC ACID
C14H11FO3 (246.06921880000002)
2-(4-Chlorophenyl)hydrazidebenzoicacid
C13H11ClN2O (246.05598659999998)
5-amino-4-cyano-1-(4-fluorophenyl)pyrazole-3-carboxylic acid
METHYL 5-OXO-3,5-DIHYDRO-2H-OXAZOLO[2,3-B]QUINAZOLINE-8-CARBOXYLATE
N4-(4-METHYLPHENYL)-2-CHLOROISONICOTINAMIDE
C13H11ClN2O (246.05598659999998)
3-FLUORO-4-METHOXY-[1,1-BIPHENYL]-4-CARBOXYLIC ACID
C14H11FO3 (246.06921880000002)
N-(5-chloropyridin-2-yl)-4-methylbenzamide
C13H11ClN2O (246.05598659999998)
(R)-Glycerol 1-(p-toluenesulfonate)
C10H14O5S (246.05619140000002)
4-oxo-5-(phenylmethoxy)-4H-Pyran-2-carboxylic acid
3-[(4-FLUOROBENZYL)OXY]BENZOIC ACID
C14H11FO3 (246.06921880000002)
2-(4-Chlorophenylcarbamyl)aniline
C13H11ClN2O (246.05598659999998)
1,1,1,2,2-Pentafluoro-6,6-dimethyl-3,5-heptanedione
C9H11F5O2 (246.06791660000002)
3-(4-Chlorobutanoyl)-1H-indole-5-carbonitrile
C13H11ClN2O (246.05598659999998)
(Z)-1-CHLORO-2-(2-(4-FLUOROPHENYL)PROP-1-EN-1-YL)BENZENE
C15H12ClF (246.06115139999997)
1beta-D-Ribofuranosyl-5-fluoropyrimidin-2(1H)-one
C9H11FN2O5 (246.06519680000002)
3,4-dihydroxy-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2H-pyran-2-one
1-[5-(Fluoromethyl)-3,4-dihydroxyoxolan-2-yl]pyrimidine-2,4-dione
C9H11FN2O5 (246.06519680000002)
N-(5-methyl-3-isoxazolyl)-1,3-benzodioxole-5-carboxamide
4-Butyl-5-propyl-1,3-selenazol-2-amine
C10H18N2Se (246.06351180000001)
Floxuridine
C9H11FN2O5 (246.06519680000002)
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BC - Pyrimidine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Floxuridine (5-Fluorouracil 2'-deoxyriboside) is a?pyrimidine?analog?and known as an?oncology antimetabolite. Floxuridine inhibits Poly(ADP-Ribose) polymerase and induces DNA damage by activating the ATM and ATR checkpoint signaling pathways in vitro. Floxuridine is a extreamly potent inhibitor for S. aureus infection and induces cell apoptosis[1][2]. Floxuridine has antiviral effects against HSV and CMV[3].
Doxifluridine
C9H11FN2O5 (246.06519680000002)
D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D019167 - Appetite Stimulants C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Same as: D01309 Doxifluridine has anticancer activity. Doxifluidine is a 5-FU prodrug. Doxifluridine is a thymidine synthase inhibitor. Doxifluridine can enhance tumor inhibition by synergizing with a variety of drugs[1][2][3].
Isopimpinellin
Isopimpinellin is found in angelica. Isopimpinellin is present in the seeds of Pastinaca sativa (parsnip) Isopimpinellin belongs to the family of Furanocoumarins. These are polycyclic aromatic compounds containing a furan ring fused to a coumarin moeity. Isopimpinellin, an orally active compound isolated from Glomerella cingulata. Isopimpinellin blocks DNA adduct formation and skin tumor initiation by 7,12-dimethylbenz[a]anthracene. Isopimpinellin possesses anti-leishmania effect[1]. Isopimpinellin, an orally active compound isolated from Glomerella cingulata. Isopimpinellin blocks DNA adduct formation and skin tumor initiation by 7,12-dimethylbenz[a]anthracene. Isopimpinellin possesses anti-leishmania effect[1].
3-carboxy-8-(methylsulfanyl)-2-oxooctanoate
C10H14O5S-2 (246.05619140000002)
N-[(E)-(2-methylphenyl)methylideneamino]thiadiazole-4-carboxamide
3-(4-Methoxyphenyl)propyl hydrogen sulate
C10H14O5S (246.05619140000002)