Exact Mass: 200.0436
Exact Mass Matches: 200.0436
Found 500 metabolites which its exact mass value is equals to given mass value 200.0436,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Camalexin
Camalexin is an indole phytoalexin that is indole substituted at position 3 by a 1,3-thiazol-2-yl group. It has a role as a metabolite. It is an indole phytoalexin and a member of 1,3-thiazoles. Camalexin is a natural product found in Arabidopsis, Arabidopsis thaliana, and Camelina sativa with data available. Camalexin is found in fats and oils. Camalexin is an alkaloid from the leaves of Camelina sativa (false flax) infected by the fungus Alternaria brassica Alkaloid from the leaves of Camelina sativa (false flax) infected by the fungus Alternaria brassicae. Camalexin is found in fats and oils. An indole phytoalexin that is indole substituted at position 3 by a 1,3-thiazol-2-yl group. D000890 - Anti-Infective Agents Camalexin is a phytoalexin isolated from Camelina sativa (Cruciferae) with antibacterial, antifungal, antiproliferative and anticancer activities. Camalexin can induce reactive oxygen species (ROS) production[1][2][3]. Camalexin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=135531-86-1 (retrieved 2024-08-14) (CAS RN: 135531-86-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
(4-Chloro-2-methylphenoxy)acetic acid
CONFIDENCE standard compound; INTERNAL_ID 579; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4601; ORIGINAL_PRECURSOR_SCAN_NO 4597 CONFIDENCE standard compound; INTERNAL_ID 579; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4590; ORIGINAL_PRECURSOR_SCAN_NO 4587 CONFIDENCE standard compound; INTERNAL_ID 579; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4578; ORIGINAL_PRECURSOR_SCAN_NO 4576 CONFIDENCE standard compound; INTERNAL_ID 579; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4593; ORIGINAL_PRECURSOR_SCAN_NO 4590 CONFIDENCE standard compound; INTERNAL_ID 579; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4563; ORIGINAL_PRECURSOR_SCAN_NO 4559 CONFIDENCE standard compound; INTERNAL_ID 579; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4587; ORIGINAL_PRECURSOR_SCAN_NO 4585 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8421 D010575 - Pesticides > D006540 - Herbicides CONFIDENCE standard compound; ML_ID 2 D016573 - Agrochemicals
2,4(1H,3H)-Pyrimidinedione, 5-fluoro-1-(tetrahydro-2-furanyl)-, (R)-
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BC - Pyrimidine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2021 - Thymidylate Synthase Inhibitor D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Same as: D01244 Tegafur (FT 207; NSC 148958) is a chemotherapeutic 5-FU proagent used in the treatment of cancers; is a component of tegafur-uracil.
Maleylacetoacetic acid
Maleylacetoacetic acid, also known as 4-maleylacetoacetate, is an intermediate in the metabolism of tyrosine. Homogentisate 1,2-dioxygenase (HGD) is the enzyme which catalyzes the conversion of homogentisate into 4-maleylacetoacetate. HGD is involved in the catabolism of aromatic rings, more specifically in the breakdown of the amino acids tyrosine and phenylalanine.
5-Carboxymethyl-2-hydroxymuconic semialdehyde
5-Methylangelicin
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins
3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]pyruvic acid
A 2-oxo monocarboxylic acid that is pyruvic acid in which one of the methyl hydrogens is replaced by a 5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl group (the 1R,2S,5R,6S stereoisomer).
Dibenzothiophene 5-oxide
A member of the class of dibenzothiophenes that is the 5-oxo derivative of dibenzothiophene.
4-Fumarylacetoacetic acid
4-Fumarylacetoacetic acid is an intermediate in the metabolism of tyrosine. Fumarylacetoacetate hydrolase (FAH) is an enzyme which catalyzes the hydrolysis of 4-fumarylacetoacetate into fumarate and acetoacetate. FAH is the last enzyme in the tyrosine catabolism pathway. FAH deficiency is associated with Type 1 hereditary tyrosinemia.
3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin
3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin is found in alcoholic beverages. 3,6-Dihydro-4-(4-methyl-3-pentenyl)-1,2-dithiin is a constituent of hops
4-Chloro-3,5-dimethoxybenzaldehyde
4-Chloro-3,5-dimethoxybenzaldehyde is found in mushrooms. 4-Chloro-3,5-dimethoxybenzaldehyde is isolated from the mycelium of Hericium erinaceum (lions mane). Isolated from the mycelium of Hericium erinaceum (lions mane). 4-Chloro-3,5-dimethoxybenzaldehyde is found in mushrooms.
(Z)-3-(1-Formyl-1-propenyl)pentanedioic acid
(Z)-3-(1-Formyl-1-propenyl)pentanedioic acid is found in fats and oils. (Z)-3-(1-Formyl-1-propenyl)pentanedioic acid is a constituent of olives (Olea europaea). Constituent of olives (Olea europaea). (Z)-3-(1-Formyl-1-propenyl)pentanedioic acid is found in fats and oils, herbs and spices, and fruits.
4-fumarylacetoacetate(2-)
4-fumarylacetoacetate(2-) is also known as 4-Fumarylacetoacetic acid dianion. 4-fumarylacetoacetate(2-) is considered to be slightly soluble (in water) and acidic
1,3-Diethyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one
Benzo[alpha]pyrene
ronidazole
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent ORIGINAL_ACQUISITION_NO 7869; CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 7868 CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7869; ORIGINAL_PRECURSOR_SCAN_NO 7868 CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4231; ORIGINAL_PRECURSOR_SCAN_NO 4227 CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4244; ORIGINAL_PRECURSOR_SCAN_NO 4242 CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4251; ORIGINAL_PRECURSOR_SCAN_NO 4249 CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4259; ORIGINAL_PRECURSOR_SCAN_NO 4256 CONFIDENCE standard compound; INTERNAL_ID 892; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4251; ORIGINAL_PRECURSOR_SCAN_NO 4248 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3695 CONFIDENCE standard compound; INTERNAL_ID 1071
N,N-Dimethyl-N-phenylsulfamide
A member of the class of sulfamides that is N-phenylsulfuric diamide substituted by two methyl groups at the amino nitrogen atom. It is a metabolite of the agrochemical dichlofluanid. CONFIDENCE standard compound; EAWAG_UCHEM_ID 296 CONFIDENCE standard compound; INTERNAL_ID 2042
4-Amino-N,N-dimethylbenzenesulfonamide
CONFIDENCE standard compound; INTERNAL_ID 2462 CONFIDENCE standard compound; INTERNAL_ID 8784 CONFIDENCE standard compound; INTERNAL_ID 8212 CONFIDENCE standard compound; INTERNAL_ID 4170 INTERNAL_ID 4170; CONFIDENCE standard compound
2,6-dioxo-1,7-dioxa-spiro[4.4]nonane-8-carboxylic acid|Dilactophorbinsaeure
6-(Hydroxymethyl)-8-hydroxy-3,4,5,6-tetrahydro-1H,8H-pyrano[3,4-c]pyran-1-one
(Z)-2-[4-(2-Thieyl)-1-buten-3-ynyl]furan|cis-1-(2-Furyl)-4-(2-thienyl)-1-buten-3-yne|cis-4-Furyl-(2)-1-thienyl-(2)-buten-(3)-in-(1)
Camalexin
D000890 - Anti-Infective Agents IPB_RECORD: 278; CONFIDENCE confident structure Camalexin is a phytoalexin isolated from Camelina sativa (Cruciferae) with antibacterial, antifungal, antiproliferative and anticancer activities. Camalexin can induce reactive oxygen species (ROS) production[1][2][3].
tegafur
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BC - Pyrimidine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2021 - Thymidylate Synthase Inhibitor D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents Same as: D01244 Tegafur (FT 207; NSC 148958) is a chemotherapeutic 5-FU proagent used in the treatment of cancers; is a component of tegafur-uracil.
Methiocarb-TP methiocarb sulfone phenol (M05)
CONFIDENCE standard compound; UCHEM_ID 4204
4-(4-Methyl-3-pentenyl)-1,2-dithia-4-cyclohexene
1H-Benzimidazole,2-methyl-1-(trifluoromethyl)-(9CI)
4-Thiazolecarboxylicacid,2-[(aminoiminomethyl)amino]-5-methyl-(9CI)
Nifuratrone
C254 - Anti-Infective Agent > C52588 - Antibacterial Agent
Methyl 2-((dimethylamino)Methyl)thiazole-4-carboxylate
2-Pyridinecarboxylicacid, 3-amino-5-chloro-, ethyl ester
(2-TERT-BUTOXYCARBONYLAMINO-THIAZOL-4-YL)-ACETICACID
ethyl 2-oxo-2-(4-oxotetrahydro-2H-pyran-3-yl)acetate
1H-Benzimidazole,1-methyl-2-(trifluoromethyl)-(9CI)
3-chloro-5-hydroxymethyl benzoic acid methyl ester
Ethyl 2-oxo-2-(2-oxotetrahydro-2H-pyran-3-yl)acetate
3-(2,4,6-TRIOXO-HEXAHYDRO-PYRIMIDIN-5-YL)-PROPIONIC ACID
ethyl 2-imino-3,4-dimethyl-1,3-thiazole-5-carboxylate
DIHYDRO-1-METHYL-3-PROPYL-2-THIOXO-4,6(1H,5H)-PYRIMIDINEDIONE
1H-Benzimidazole,5-methyl-2-(trifluoromethyl)-(9CI)
Benzenemethanamine, 4-chloro-a-methyl-2-nitro-, (aR)
5-(Aminomethyl)-1,3-benzoxazol-2(3H)-one hydrochloride (1:1)
(4-CHLORO-5-METHYL-3-TRIFLUOROMETHYL-PYRAZOL-1-YL)-ACETICACID
8-Methoxy-4-oxo-1,4-dihydro-3-quinolinecarbonitrile
6-Methoxy-4-oxo-1,4-dihydro-3-quinolinecarbonitrile
(5-chloro-2-methoxyphenyl)-(3,5-dichlorophenyl)methanone
1,2,3-Thiadiazole-5-carboxylicacid,4-(1-methylethyl)-,ethylester(9CI)
2-Propynoic acid,3-(1-methyl-1H-benzimidazol-2-yl)-
7-Methoxy-4-oxo-1,4-dihydro-3-quinolinecarbonitrile
5-Pyrimidinecarboxylicacid, 1,2,3,4-tetrahydro-4-oxo-2-thioxo-, ethyl ester
2-carboxymethylthio-6-methyl-3,4-dihydropyrimidin-4-one
2-[2-(3-methylpyrazol-1-yl)ethylsulfanyl]acetic acid
6,7-DIHYDRO-4H-PYRAZOLO[5,1-C][1,4]THIAZINE-2-CARBALDEHYDE 5,5-DIOXIDE
4-METHYL-5,6,7,8-TETRAHYDRO-2LAMBDA6,1,3-BENZOTHIADIAZINE-2,2(1H)-DIONE
2H-Isoindole-2-propanenitrile,1,3-dihydro-1,3-dioxo-
1,3-Dioxolane,2-[(3,4-difluorophenyl)methyl]-(9CI)
4,6-dihydroxy-4-(trifluoromethyl)tetrahydropyran-2-one
1,2-Cyclopentanedicarboxylic acid, 4-oxo-, 1,2-dimethyl ester, (1R,2R)-
6-METHOXY-2-OXO-1,2-DIHYDRO-QUINOLINE-3-CARBONITRILE
5-(ethoxymethylene)-2,2-dimethyl-1,3-dioxane-4,6-dione
7-Methoxy-4-oxo-1,4-dihydroquinoline-6-carbonitrile
4-METHOXY-2-(METHYLTHIO)-5-PYRIMIDINECARBOXYLIC ACID
5-(Methoxycarbonyl)-4-methylthiophene-2-boronic acid
2-(3-Methoxyallylidene)malonic acid dimethyl ester, 95\\%
4-Pyridinecarboxylicacid, 2-amino-6-chloro-, ethyl ester
[2-(5-methyl-pyrazol-1-yl)-ethylsulfanyl]-acetic acid
Thiazolo[5,4-c]pyridine-2(1H)-thione, 5-ethyl-4,5,6,7-tetrahydro- (9CI)
(2s,3s)-3-(4-Fluorophenyl)-2,3-Dihydroxypropanoic Acid
(2R,3S,4R,5S)-2,6-difluoro-2-(hydroxymethyl)oxane-3,4,5-triol
(E)-2-hydroxy-3-[(E)-3-oxobut-1-enyl]but-2-enedioic acid
(2Z,4E)-4-Hydroxy-6-oxo-2,4-octadienedioic acid
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
5-(2-Hydroxyethoxycarbonyl)furan-2-carboxylic acid
cis-4,5-Dihydroxycyclohexa-2,6-diene-1,2-dicarboxylic acid
(3S,4R)-3,4-dihydroxycyclohexa-1,5-diene-1,4-dicarboxylic acid
(2Z,4E)-4-hydroxy-6-oxoocta-2,4-dienedioic acid
An oxodicarboxylic acid that is a tautomer of 4-maleylacetoacetic acid in which the carbonyl of the alpha,beta-unsaturated ketone moiety has tautomerised to the corresponding enol (the 2Z,4E isomer).
4-methyl-1,7-diazatricyclo[7.3.0.0³,⁷]dodeca-3,5,9,11-tetraene-2,8-dione
4-hydroxy-6,6a-bis(hydroxymethyl)-3h,3ah,4h-cyclopenta[b]furan-2-one
methyl 2-[(1s,6s)-1,6-dihydroxy-4-oxocyclohex-2-en-1-yl]acetate
2,6-diazatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),6,8,10-hexaene-11,12-diol
methyl 2-(2-hydroxy-3,4-dimethyl-5-oxofuran-2-yl)acetate
7-hydroxy viteoid ii
{"Ingredient_id": "HBIN013293","Ingredient_name": "7-hydroxy viteoid ii","Alias": "NA","Ingredient_formula": "C9H12O5","Ingredient_Smile": "C1COC(=O)C2=C(C(C(C21)O)O)CO","Ingredient_weight": "200.19 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10824","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11095628","DrugBank_id": "NA"}
