Exact Mass: 372.0401
Exact Mass Matches: 372.0401
Found 239 metabolites which its exact mass value is equals to given mass value 372.0401,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Dothistromin
QUIZALOFOP-ETHYL
CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10197; ORIGINAL_PRECURSOR_SCAN_NO 10195 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10169; ORIGINAL_PRECURSOR_SCAN_NO 10168 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10194; ORIGINAL_PRECURSOR_SCAN_NO 10192 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10142; ORIGINAL_PRECURSOR_SCAN_NO 10140 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10217; ORIGINAL_PRECURSOR_SCAN_NO 10216 ORIGINAL_ACQUISITION_NO 10194; CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 10192 CONFIDENCE standard compound; INTERNAL_ID 430; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10226; ORIGINAL_PRECURSOR_SCAN_NO 10224 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
Gomphidic acid
Gomphidic acid is found in mushrooms. Gomphidic acid is a pigment from the lichen Gomphidius glutinosus (spike cap). Pigment from the lichen Gomphidius glutinosus (spike cap). Gomphidic acid is found in mushrooms.
Sulindac sulfone
Sulindac sulfone is a metabolite of sulindac. Sulindac is a non-steroidal anti-inflammatory drug of the arylalkanoic acid class that is marketed in the UK & U.S. by Merck as Clinoril. (Wikipedia)
Glafenine
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics N - Nervous system > N02 - Analgesics
(5Z)-5-[(2-Benzyl-5-hydroxy-4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Edetate disodium
Preservative and sequestrant in foods. Ethylenediaminetetraacetic acid, widely abbreviated as EDTA, is a polyamino carboxylic acid and a colourless, water-soluble solid. Its conjugate base is named ethylenediaminetetraacetate. It is widely used to dissolve limescale. Its usefulness arises because of its role as a hexadentate (six-toothed") ligand and chelating agent Preservative and sequestrant in foods
3-butenylglucosinolate
3-butenylglucosinolate is soluble (in water) and an extremely strong acidic compound (based on its pKa). 3-butenylglucosinolate can be found in a number of food items such as kohlrabi, american cranberry, linden, and lemon balm, which makes 3-butenylglucosinolate a potential biomarker for the consumption of these food products.
Norstictic acid
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
5-Hydroxy-3,4,5-trimethoxy-6,7-methylenedioxyisoflavone
4-Hydroxy-5,6,7-trimethoxy-3-(3,4-methylenedioxy)phenylcoumarin
7-Hydroxy-3,5,8-trimethoxy-3,4-methylenedioxyflavone
5-Hydroxy-3,7,8-trimethoxy-3,4-methylenedioxyflavone
glafenine
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics N - Nervous system > N02 - Analgesics
7-chloro-4,6-dimethoxy-3a,12a-dihydro-5h-furo[3,2:4,5]furo[3,2-b]xanthen-5-one
5aH-6,11:11,13a-Diepoxy-10,11,12,13-tetrahydro-1,5a,10-trihydroxy-9-methylcyclodeca[b]naphthalene-5,7,14(6H)-trione
5,5,6,6-Tetrahydro-6,6-cyclo-5,5-bi[7H-furo[3,2-g][1]benzopyran]-7,7-dione
4,5-[Oxy(3,6-dimethyl-5-methoxy-1,2-phenylene)carbonyloxy]-6-methyl-3,7-dihydroxyisobenzofuran-1(3H)-one
Acetic acid 7-bromo-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl ester
9,10-dihydro-6-hydroxy-5,7,8-trimethoxy-9,10-dioxoanthracen-2-yl acetate
1,6-diacetoxy-2,8-dimethoxy-xanthen-9-one|3,8-Diacetoxy-1,7-dimethoxyxanthon (Isogentiacanlein)
8-Butyryl-1,4,5,7-tetrahydroxy-2-methoxy-anthrachinon|8-Hydroxy,7-Me ether-Rhodocomatulin-8-Hydroxy,7-Me ether|rubrocomatulin 6-methyl ether
(1)Benzopyrano(5,4,3-cde)(1,3)dioxolo(4,5-h)(1)benzopyran-5,11-dione, 1,2,3-trimethoxy-
3,8-dihydroxy-4,7-dimethoxy-1-methylanthraquinone-2-carboxylic acid methyl ester
5-hydroxy-3,6,8-trimethoxy-3,4-methylenedioxyflavone
2,3-dicarboxy-6,7-dihydroxy-1-(3,4-dihydroxy)-phenyl-1,2-dihydronaphthalene-10-methyl ester
4-acetoxy-6-(3,4-diacetoxy-styryl)-pyran-2-one|Tri-O-acetyl-hispidin
5-hydroxyisopsorofebrin|O-De-Me,11-O-Me,1-hydroxy-2,3,3a,12c-Tetrahydro-3,11-dihydroxy-6-methoxy-3-methyl-7H-furo[2,3:4,5]furo[2,3-c]xanthen-7-one,
Topopyrone B
A naphthochromene that is 4H-naphtho[2,3-g]chromene-4,6,11-trione substituted by a chloro group at position 8, hydroxy groups at positions 5, 7 and 9 and a methyl group at position 2. It is isolated from a fungal strain Phoma sp.BAUA2861 and acts as an inhibitor of the enzyme topoisomerase I. D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059004 - Topoisomerase I Inhibitors D004791 - Enzyme Inhibitors
Topopyrone A
A naphthochromene that is 4H-naphtho[2,3-h]chromene-4,7,12-trione substituted by a chloro group at position 10, hydroxy groups at positions 5, 9 and 11 and a methyl group at position 2. It is isolated from a fungal strain Phoma sp.BAUA2861 and acts as an inhibitor of the enzyme topoisomerase I. D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059004 - Topoisomerase I Inhibitors D004791 - Enzyme Inhibitors
Eckol
Eckol is a phlorotannin that is oxanthrene-1,3,6,8-tetrol substituted by a 3,5-dihydroxyphenoxy moiety at position 4. Isolated from the marine brown alga, Ecklonia cava, it exhibits antioxidant activity. It has a role as a metabolite and an antioxidant. It is functionally related to a phloroglucinol. Eckol is a natural product found in Ecklonia cava, Ecklonia maxima, and Eisenia bicyclis with data available. A phlorotannin that is oxanthrene-1,3,6,8-tetrol substituted by a 3,5-dihydroxyphenoxy moiety at position 4. Isolated from the marine brown alga, Ecklonia cava, it exhibits antioxidant activity.
9-Hydroxy-7-(3,4,5-trimethoxyphenyl)-8H-1,3-dioxolo[4,5-g][1]benzopyran-8-one
4-hydroxy-austrocorticinic acid|4-Hydroxyaustrocorticinic acid
5,6,7,8-tetrahydroxycoumarin-5-beta-glucopyranoside
4,6-Diformyl-3,8-dihydroxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|4,6-diformyl-3,8-dihydroxy-1,9-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid
Norstictic_acid
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates Norstictic acid is a natural product found in Buellia, Dimelaena, and other organisms with data available.
3,4,5-Tmmf
(1)Benzopyrano(5,4,3-cde)(1,3)dioxolo(4,5-h)(1)benzopyran-5,11-dione, 1,2,3-trimethoxy- is a natural product found in Camptotheca acuminata and Miconia affinis with data available.
(4R,8S)-17-chloro-2,18-dimethoxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1(12),2,5,10,14,16,18-heptaen-20-one
Penicillin G potassium
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
(4R,8S)-17-chloro-2,18-dimethoxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹?.0?,?.0¹?,¹?]icosa-1(12),2,5,10,14,16,18-heptaen-20-one
Gomphidic acid
Oxametacin
M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
3,6-bis[4-(trifluoromethyl)phenyl]-1,4-dihydro-1,2,4,5-tetrazine
3-phenyl-5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-1,2,4-oxadiazole
7-HYDROXY-3-(1-PHENYL-1H-PYRAZOL-4-YL)-2-TRIFLUOROMETHYL-CHROMEN-4-ONE
6-[[2,8-bis(trifluoromethyl)quinolin-4-yl]methyl]pyridin-3-ol
2-(2-(2-FLUOROPHENYL)-5-HYDROXY-8-METHYL-7-OXO-7,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-6-CARBOXAMIDO)ACETIC ACID
quizalofop-P-ethyl
D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
TETRAKIS(ACETONITRILE)COPPER (I) HEXAFLUOROPHOSPHATE
4-(TERT-BUTYL)-2,6-DIMETHYL-3,5-DINITROPHENACYL BROMIDE
Clazuril
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
tert-Butyl 4-(2-bromo-4-fluorobenzyl)piperazine-1-carboxylate
2-Bromo-13,13-dimethyl-13H-indeno[1,2-b]anthracene
2-(4-BOC-Piperazinomethyl)-1-bromo-3-fluorobenzene
Exisulind
D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor > C2127 - cGMP Phosphodiesterase Inhibitor D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D020011 - Protective Agents > D016588 - Anticarcinogenic Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors
methyl(S)-1-((S)-2-(5-bromo-1H-imidazol-2-yl)pyrrolidin-1-yl)-3-methyl-1-oxobutan-2-ylcarbamate
METHYL 4-IODO-1-(4-METHOXYBENZYL)-1H-PYRAZOLE-3-CARBOXYLATE
4,5-Dioxo-4,5-dihydro-1H-pyrrol[2,3-f]quinoline-2,7,9-tricarboxylic acid trimethyl ester
4-Bromo-2-(4-BOC-piperazinomethyl)-1-fluorobenzene
2-(3-Methoxyphenyl)-2h-thieno-[3,2-e]-1,2-thiazine-6-sulfinamide-1,1-dioxide
Hexadimethrini bromidum
D006401 - Hematologic Agents > D003029 - Coagulants > D006494 - Heparin Antagonists D001697 - Biomedical and Dental Materials
6-[(3-Aminophenyl)methyl]-4,6-dihydro-4-methyl-2-(methylsulfinyl)-5h-thieno[2,3:4,5]pyrrolo[2,3-d]pyridazin-5-one
(2Z,5Z)-5-(4-hydroxy-3,5-dimethoxybenzylidene)-2-((4-hydroxyphenyl)imino)thiazolidin-4-one
ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
[4-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-2-methoxyphenyl] 4-methylbenzenesulfonate
4-[4-Amino-6-(2,6-dichloro-phenoxy)-[1,3,5]triazin-2-ylamino]-benzonitrile
(Z)-3-Benzyl-5-(2-Hydroxy-3-Nitrobenzylidene)-2-Thioxothiazolidin-4-One
3-[1-(4-Bromo-phenyl)-2-methyl-propyl]-4-hydroxy-chromen-2-one
Edetate disodium
D064449 - Sequestering Agents > D002614 - Chelating Agents > D065096 - Calcium Chelating Agents D000074385 - Food Ingredients > D005503 - Food Additives D006401 - Hematologic Agents > D000925 - Anticoagulants
deacetylcephalosporin C(1-)
A cephalosporin carboxylic acid anion that is the conjugate base of deacetylcephalosporin C, arising from deprotonation of both carboxy groups and protonation of the amino group; major species at pH 7.3.
5-Methoxy-6-methylbenzimidazole ribotide phosphate
2-Hydroxy-5-[(6-sulfonaphthalen-2-yl)diazenyl]benzoic acid
[(2R,3S,4R,5S)-5-(5-cyano-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
(5Z)-5-[(2-Benzyl-5-hydroxy-4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
[(Z)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylpent-4-enylideneamino] sulfate
1-S-[(1Z)-N-(sulfonatooxy)pent-4-enimidoyl]-1-thio-beta-D-glucopyranose
N1-{3-[2-(2-pyridyl)ethyl]phenyl}-4-chlorobenzene-1-sulfonamide
5-[(4-chloro-1-pyrazolyl)methyl]-N-(6-methyl-1,3-benzothiazol-2-yl)-2-furancarboxamide
3-chloro-5-(2-furanyl)-N-propan-2-yl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide
2-[[(6-bromo-1H-benzimidazol-2-yl)thio]methyl]-1-methylbenzimidazole
2-(6-Imidazo[2,1-b]thiazolyl)acetic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester
(2-Morpholin-4-yl-2-oxoethyl) 4-methylsulfonyl-3-nitrobenzoate
N-{(E)-[5-(3-bromophenyl)furan-2-yl]methylidene}-3-methyl-1H-pyrazole-5-carbohydrazide
1-[[1-[(4-Chlorophenyl)methyl]-2-oxo-3-indolylidene]amino]-3-ethylthiourea
N-[(E)-(6-chloro-4-oxo-4H-chromen-3-yl)methylidene]-4-hydroxy-3-methoxybenzohydrazide
N-[4-[methyl(phenyl)sulfamoyl]phenyl]-2-thiophenecarboxamide
N-[2,5-dimethoxy-4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-furancarboxamide
N-(4-hydroxyphenyl)-N-methyl-N-thiophen-2-ylsulfonylbenzenecarboximidamide
(17S)-5,13,17-trihydroxy-7,12-dimethyl-9,15-dioxo-2,10,16-trioxatetracyclo[9.7.0.03,8.014,18]octadeca-1(11),3(8),4,6,12,14(18)-hexaene-4-carbaldehyde
2-{[(2E)-3-iodoprop-2-en-1-yl](propyl)ammonio}tetralin-7-ol(1+)
[2-Hydroxy-5-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen sulate
3,4,5-trihydroxy-6-[(E)-3-(2,4,5-trihydroxyphenyl)prop-2-enoyl]oxyoxane-2-carboxylic acid
(2R,3S,4R,5S)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2,3,4,5-tetrahydroxyhexanedioic acid
2-[(3E)-6-fluoro-2-(hydroxymethyl)-3-[[4-[(S)-methylsulfinyl]phenyl]methylidene]inden-1-yl]acetic acid
[5-[2-amino-5-(azaniumylmethyl)-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl]-3-hydroxy-2,5-dihydrofuran-2-yl]methyl phosphate
QUIZALOFOP-ETHYL
D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
Impatienol(2-)
An enolate anion that is the dianion obtained by the deprotonation of the enol groups of impatienol.
(1r,2s,14s,15r)-8,12,17,21-tetraoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁵,⁹.0¹⁸,²⁶.0²⁰,²⁴]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione
2-(2h-1,3-benzodioxol-5-yl)-7-hydroxy-3,5,8-trimethoxychromen-4-one
1-hydroxy-16,17-dimethoxy-5,7,11,14-tetraoxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15,17,19-hexaen-21-one
2,4,6,15,18-pentahydroxy-7,9-dioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1,3(10),11,14,16,18-hexaene-13,20-dione
(2s,3s)-3-(3,4-dihydroxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-5-oxooxolane-2-carboxylic acid
8,12,17,21-tetraoxaheptacyclo[13.11.0.0²,¹⁴.0³,¹¹.0⁵,⁹.0¹⁸,²⁶.0²⁰,²⁴]hexacosa-3(11),4,6,9,18(26),19,22,24-octaene-13,16-dione
8-chloro-4,7,12-trihydroxy-3-methyl-3,4-dihydro-2h-tetracene-1,6,11-trione
(6s)-6,11-dihydroxy-2,3,9-trimethoxy-6h-5,7-dioxatetraphen-12-one
13,14-dihydroxy-15-methoxy-4-methyl-5,10,19-trioxapentacyclo[9.8.1.0¹,⁸.0³,⁷.0¹²,¹⁷]icosa-3,6,12(17),13,15-pentaene-2,9-dione
(17r)-13,17-dihydroxy-5-methoxy-4,7,12-trimethyl-2,10,16-trioxatetracyclo[9.7.0.0³,⁸.0¹⁴,¹⁸]octadeca-1(11),3,5,7,12,14(18)-hexaene-9,15-dione
3-(2h-1,3-benzodioxol-5-yl)-4-hydroxy-5,6,7-trimethoxychromen-2-one
3,4-methylenedioxy-3',4'-o-dimethyl-5'-me-thoxyellagicacid
{"Ingredient_id": "HBIN007497","Ingredient_name": "3,4-methylenedioxy-3',4'-o-dimethyl-5'-me-thoxyellagicacid","Alias": "NA","Ingredient_formula": "C18H12O9","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14359","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
