Exact Mass: 277.0505672
Exact Mass Matches: 277.0505672
Found 315 metabolites which its exact mass value is equals to given mass value 277.0505672,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
METAZACHLOR
C14H16ClN3O (277.09818359999997)
CONFIDENCE standard compound; EAWAG_UCHEM_ID 269 CONFIDENCE standard compound; INTERNAL_ID 3539 CONFIDENCE standard compound; INTERNAL_ID 8416 CONFIDENCE standard compound; INTERNAL_ID 4036 CONFIDENCE standard compound; INTERNAL_ID 31
Azathioprine
Azathioprine is only found in individuals that have used or taken this drug. It is an immunosuppressive pro-drug. It is converted into 6-mercaptopurine in the body where it blocks purine metabolism and DNA synthesis.Azathioprine antagonizes purine metabolism and may inhibit synthesis of DNA, RNA, and proteins. It may also interfere with cellular metabolism and inhibit mitosis. Its mechanism of action is likely due to incorporation of thiopurine analogues into the DNA structure, causing chain termination and cytotoxicity. L - Antineoplastic and immunomodulating agents > L04 - Immunosuppressants > L04A - Immunosuppressants C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents C308 - Immunotherapeutic Agent > C574 - Immunosuppressant D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents D018501 - Antirheumatic Agents Azathioprine (BW 57-322) is an orally active immunosuppressive agent. Azathioprine can be converted in vivo to the active metabolite 6-mercaptopurine (6-MP). Azathioprine has myelosuppressive effects and induces apoptosis[1][3].
Fenitrothion
Fenitrothion (IUPAC name: O,O-Dimethyl O-(3-methyl-4-nitrophenyl) phosphorothioate) is a phosphorothioate (organophosphate) insecticide; cheap and widely used worldwide. D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor D016573 - Agrochemicals
trans-2-((Dimethylamino)methylimino)-5-(2-(5-nitro-2-furyl)vinyl)-1,3,4-oxadiazole
Arprinocid
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent CONFIDENCE standard compound; INTERNAL_ID 1082
JNJ-7777120
C14H16ClN3O (277.09818359999997)
JNJ-7777120 is a potent and selective histamine H4 receptor antagonist (Ki=4.5 nM). JNJ-7777120 effectively blocks histamine-induced migration of mouse tracheal mast cells from connective tissue to epithelial cells. JNJ-7777120 also significantly blocks neutrophil infiltration in a mouse Zymosan-induced peritonitis model. JNJ-7777120 has a good potential to study antipruritic and anti-inflammatory[1][2].
DOPA sulfate
Increases in plasma dopamine sulfate and urinary dopamine suggest that dopamine sulfate may be generated via DOPA sulfate and urinary dopamine may originate from circulating DOPA. DOPA sulfate may be an alternative source of dopamine sulfate. Urinary dopamine progressively increased in the course of metyrosine treatment, and this, along with the increase of the dopamine metabolite, dihydroxyphenylethanol, and plasma dopamine sulfate, occurred in the absence of any change in plasma dopamine.(PMID: 1969915). Increases in plasma dopamine sulfate and urinary dopamine suggest that dopamine sulfate may be generated via DOPA sulfate and urinary dopamine may originate from circulating DOPA. DOPA sulfate may be an alternative source of dopamine sulfate.
Furilazole
Furilazole (CAS: 121776-33-8) belongs to the class of organic compounds known as oxazolidines. Oxazolidines are compounds containing an oxazolidine moiety, which consists of a saturated aliphatic five-member ring with one oxygen atom, one nitrogen, three carbon atoms, and two double bonds. Furilazole is an extremely weak basic (essentially neutral) compound (based on its pKa). Furilazole is a dichloroacetamide herbicide safener for gramineous crops. Herbicide safener for gramineous crops
N-(2-hydroxymethyl-3-chlorophenyl)anthranilic acid
N-(2-hydroxymethyl-3-chlorophenyl)anthranilic acid belongs to the family of Aminobenzoic Acid Derivatives. These are organic compounds containing a benzoic acid moiety with an amine group attached to the benzene ring.
N-(2-methyl-3-chloro-4-hydroxyphenyl)anthranilic acid
N-(2-methyl-3-chloro-4-hydroxyphenyl)anthranilic acid belongs to the family of Aminobenzoic Acid Derivatives. These are organic compounds containing a benzoic acid moiety with an amine group attached to the benzene ring.
N-(2-methyl-3-chloro-5-hydroxyphenyl)anthranilic acid
N-(2-methyl-3-chloro-5-hydroxyphenyl)anthranilic acid belongs to the family of Aminobenzoic Acid Derivatives. These are organic compounds containing a benzoic acid moiety with an amine group attached to the benzene ring.
2-Chloro-5-nitro-N-4-pyridinylbenzamide
T0070907 is a potent PPARγ antagonist with a Ki of 1 nM.
7-Hydroxyflumequine
3-[(2Z,3E)-3-(Hydroxyimino)-2,3-dihydro-1H-indol-2-ylidene]-2,3-dihydro-1H-indol-2-one
Indirubin-3'-monoxime
Indirubin-3'-monoxime is a potent GSK-3β inhibitor, and weakly inhibits 5-Lipoxygenase, with IC50s of 22 nM and 7.8-10 μM, respectively; Indirubin-3'-monoxime also shows inhibitory activities against CDK5/p25 and CDK1/cyclin B, with IC50s of 100 and 180 nM.
1-[(5-Chloro-1H-indol-2-yl)carbonyl]-4-methylpiperazine
C14H16ClN3O (277.09818359999997)
JNJ-7777120 is a potent and selective histamine H4 receptor antagonist (Ki=4.5 nM). JNJ-7777120 effectively blocks histamine-induced migration of mouse tracheal mast cells from connective tissue to epithelial cells. JNJ-7777120 also significantly blocks neutrophil infiltration in a mouse Zymosan-induced peritonitis model. JNJ-7777120 has a good potential to study antipruritic and anti-inflammatory[1][2].
Neridronic acid
C78281 - Agent Affecting Musculoskeletal System > C67439 - Bone Resorption Inhibitor D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates
(3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone
C13H8FNO5 (277.03864899999996)
3-Nitro-3,3a-dihydrobenzo[b]phenalen-7-one
C17H11NO3 (277.07388960000003)
Sulfoxaflor
C10H10F3N3OS (277.04966459999997)
1-(2,6-Dichlorophenyl)-2-indolinone
CONFIDENCE standard compound; INTERNAL_ID 1150; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8994; ORIGINAL_PRECURSOR_SCAN_NO 8993 CONFIDENCE standard compound; INTERNAL_ID 1150; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9003; ORIGINAL_PRECURSOR_SCAN_NO 9001 CONFIDENCE standard compound; INTERNAL_ID 1150; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9038; ORIGINAL_PRECURSOR_SCAN_NO 9036 CONFIDENCE standard compound; INTERNAL_ID 1150; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9062; ORIGINAL_PRECURSOR_SCAN_NO 9058 CONFIDENCE standard compound; INTERNAL_ID 1150; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9039; ORIGINAL_PRECURSOR_SCAN_NO 9035
N-[6-(Acetoxymethyl)-3,4-dihydro-4-oxopteridine-2-yl]acetamide
desulfo-but-3-enyl GL|desulfogluconapin|DS-GNA
C11H19NO5S (277.09838840000003)
p-Toluolsulfonsaeure-(4-methylamino-phenyl)-ester|toluene-4-sulfonic acid-(4-methylamino-phenyl ester)|Toluol-4-sulfonsaeure-(4-methylamino-phenylester)
2-[2-(Acetyloxy)phenyl]-4-thiazolecarboxylic acid methyl ester
T0070907
T0070907 is a potent PPARγ antagonist with a Ki of 1 nM.
INDIRUBIN-3-MONOXIME
A member of the class of biindoles that is indirubin in which the keto group at position 3 has undergone condensation with hydroxylamine to form the corresponding oxime. Indirubin-3'-monoxime is a potent GSK-3β inhibitor, and weakly inhibits 5-Lipoxygenase, with IC50s of 22 nM and 7.8-10 μM, respectively; Indirubin-3'-monoxime also shows inhibitory activities against CDK5/p25 and CDK1/cyclin B, with IC50s of 100 and 180 nM.
azathioprine
L - Antineoplastic and immunomodulating agents > L04 - Immunosuppressants > L04A - Immunosuppressants C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents C308 - Immunotherapeutic Agent > C574 - Immunosuppressant D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents D018501 - Antirheumatic Agents CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2581; ORIGINAL_PRECURSOR_SCAN_NO 2579 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2599; ORIGINAL_PRECURSOR_SCAN_NO 2597 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2587; ORIGINAL_PRECURSOR_SCAN_NO 2585 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2583; ORIGINAL_PRECURSOR_SCAN_NO 2581 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2606; ORIGINAL_PRECURSOR_SCAN_NO 2603 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2606; ORIGINAL_PRECURSOR_SCAN_NO 2604 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5597; ORIGINAL_PRECURSOR_SCAN_NO 5595 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5599; ORIGINAL_PRECURSOR_SCAN_NO 5597 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5624; ORIGINAL_PRECURSOR_SCAN_NO 5622 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5605; ORIGINAL_PRECURSOR_SCAN_NO 5603 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5625; ORIGINAL_PRECURSOR_SCAN_NO 5623 CONFIDENCE standard compound; INTERNAL_ID 1262; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5634; ORIGINAL_PRECURSOR_SCAN_NO 5633 CONFIDENCE standard compound; INTERNAL_ID 8328 Azathioprine (BW 57-322) is an orally active immunosuppressive agent. Azathioprine can be converted in vivo to the active metabolite 6-mercaptopurine (6-MP). Azathioprine has myelosuppressive effects and induces apoptosis[1][3].
DOPA sulfate
S-Methyl-L-thiocitrulline dihydrochloride
ethyl 3-amino-5-(4-methoxyphenyl)thiophene-2-carboxylate
4-[[(2,5-dimethylfuran-3-carbonyl)amino]methyl]-5-methylfuran-2-carboxylic acid
Sulfoxaflor
C10H10F3N3OS (277.04966459999997)
Sulfoxaflor is a sulfoximine insecticide and is an agonist of nAChR1 and nAChR2 subtypes. Sulfoxaflor is used for the control of sap-feeding insects such as Myzus persicae, Aphis gossypii, Bemissia tabaci and Nilaparvata lugens[1].
methyl 5,5,5-trifluoro-4-(4-fluorophenyl)iminopentanoate
Methyl 5,5,5-trifluoro-4-(4-fluorophenylamino)pent-3-enoate
2-[(3,5-DICHLORO-2-HYDROXYBENZYLIDENE)AMINO]-2-METHYLPROPANE-1,3-DIOL
1-(4-BROMOPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE
Guanidine,N-(4-chlorophenyl)-N-(1,6-dihydro-4-methyl-6-oxo-2-pyrimidinyl)-
tert-Butyl 4-(bromomethyl)piperidine-1-carboxylate
C11H20BrNO2 (277.06773200000003)
11H-Benzo[a]carbazole-3-carboxylicacid, 2-hydroxy-
C17H11NO3 (277.07388960000003)
1-Bromo-3-chloro-5,5-dimethylhydantoin
C12H17Cl2NO2 (277.06362820000004)
2-Amino-N-(5-chloro-2-pyridinyl)-5-methoxybenzamide
methyl 2-{[(benzyloxy)carbonyl]amino}-2-(oxetan-3-ylidene)acetate
1-Pyrrolidinecarboxylic acid, 3-(2-bromoethyl)-, 1,1-dimethylethyl ester
C11H20BrNO2 (277.06773200000003)
5-(2-FURYL)-3-THIEN-2-YL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOTHIOAMIDE
Methyl 1-(6-chloropyridin-2-yl)-5-cyclopropyl-1H-pyrazole-4-carboxylate
Pentanoic acid, 2-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-4-methyl-, (2S)-
Ethyl 5-acetyl-6-oxo-2-(trifluoromethyl)-1,6-dihydro-3-pyridineca rboxylate
2-(2,5-dichloropyridin-4-yl)-1-Methyl-1H-benzo[d]imidazole
[3-(3-chloropropylsulfonylamino)phenyl]boronic acid
4-OXO-PIPERIDINE-1,3-DICARBOXYLIC ACID 1-BENZYL ESTER
Pyridinium,2-methyl-1-(2-phenylethyl)-, bromide (1:1)
1-[1-(CYCLOPROPYLMETHYL)-4-PIPERIDINYL]METHANAMINE
3-Bromo-4-oxopiperidine-1-carboxylic acid tert-butyl ester
2-tert-butyl-7-chloro-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
2-AMINO-4-(4-ETHOXYPHENYL)THIOPHENE-3-CARBOXYLICACIDMETHYLESTER
5-[(3-Methoxyphenylamino)Methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione
tert-butyl 2-(bromomethyl)piperidine-1-carboxylate
C11H20BrNO2 (277.06773200000003)
4-chloro-3-[[(4-methoxyphenyl)methylamino]methyl]pyridin-2-amine
C14H16ClN3O (277.09818359999997)
ETHYL 2-METHYL-2-((5-(TRIFLUOROMETHYL)PYRIDIN-2-YL)OXY)PROPANOATE
ethyl 5-amino-3-methylsulfanyl-1-phenylpyrazole-4-carboxylate
Methyl 4-hydroxy-2-(trifluoromethyl)thieno[3,4-b]pyridine-7-carboxylate
N-[4-(trifluoromethyl)phenyl]-1H-benzimidazol-2-amine
3-BENZOYLQUINOLINE-4-CARBOXYLICACID
C17H11NO3 (277.07388960000003)
(S)-TERT-BUTYL 3-(BROMOMETHYL)PIPERIDINE-1-CARBOXYLATE
C11H20BrNO2 (277.06773200000003)
6,7-DIETHOXY-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID
7-Chloro-3a-(trifluoromethyl)-3,3a-dihydrobenzo[d]pyrrolo[2,1-b]oxazol-1(2H)-one
2-AMINO-1-(3-(BENZYLOXY)PHENYL)ETHANONE HYDROCHLORIDE
C15H16ClNO2 (277.08695059999997)
Pentanoic acid, 2-[(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-4-methyl-,(2R)-
N-(4-HYDROXY-PHENYL)-4,N-DIMETHYL-BENZENESULFONAMIDE
1-(Piperidin-4-yl)piperazine trihydrochloride
C9H22Cl3N3 (277.08792220000004)
5-(3-Chlorobenzyl)-4-ethoxy-6-methyl-2-pyrimidinamine
C14H16ClN3O (277.09818359999997)
2-(Methylsulfonyl)-10H-phenothiazine
C13H11NO2S2 (277.02311860000003)
2,2-[(4-Amino-3-nitrophenyl)imino]bisethanol hydrochloride
3-(2-Bromoacetamido)-Proxyl, Free Radical
C10H18BrN2O2 (277.05515679999996)
3-(4-Chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-N-methyl-1,2,4-oxadiaz ole-5-carboxamide
C11H8ClN5O2 (277.03664979999996)
1,2-Ethanedione, 1-(6-Methyl-2-pyridinyl)-2-(6-quinoxalinyl)-
ETHYL 2-(BENZO[D][1,3]DIOXOL-5-YL)THIAZOLE-4-CARBOXYLATE
Sodium theophylline glycinate
C9H12N5NaO4 (277.07869519999997)
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D058905 - Purinergic Agents > D058914 - Purinergic Antagonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
Ethyl 2-amino-4-(4-methoxyphenyl)-3-thiophenecarboxylate
(3R,4R)-N-CBZ-3,4-DIFLUOROPYRROLIDINEHYDROCHLORIDE
2-[(7-hydroxy-4-methyl-2-oxo-chromen-6-yl)methyl-methyl-ammonio]acetate
methyl (E)-3-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate
2-(METHYLTHIO)-4-[(2-METHOXYPHENYL)AMINO]-5-PYRIMIDINEMETHANOL
TERT-BUTYL (3,6-DICHLOROPYRIDAZIN-4-YL)METHYLCARBAMATE
2-AMINO-4-(4-METHOXY-PHENYL)-5-METHYL-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
2-AMINO-2-(3,4,5-TRIMETHOXYPHENYL)ACETIC ACID HYDROCHLORIDE
(2,4-DICHLORO-5-(2-(DIMETHYLAMINO)ETHOXY)PHENYL)BORONIC ACID
C10H14BCl2NO3 (277.04437440000004)
2-AMINO-4-(5-METHYLFURAN-2-YL)-5H-INDENO[1,2-D]PYRIMIDIN-5-ONE
Ethylmethylthiambutene
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent
N-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)HYDRAZINECARBOTHIOAMIDE
C12H15N5OS (277.09972600000003)
Ganciclovir sodium
C9H12N5NaO4 (277.07869519999997)
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
ETHYL 3-(2-CARBOXY-VINYL)-5-FLUORO-1H-INDOLE-2-CARBOXYLATE
DL-3-(4-BIPHENYL)ALANINE HYDROCHLORIDE
C15H16ClNO2 (277.08695059999997)
2,4,5-TRIFLUORO-N-(1-HYDROXY-2-METHYL PROPAN-2-YL)-3-METHOXYBENZAMIDE
(R)-2-(4-TRIFLUOROMETHYL-PHENYL)-THIAZOLIDINE-4-CARBOXYLIC ACID
ethyl 5-amino-4-(2-nitrophenyl)-1,2-oxazole-3-carboxylate
7-Chloro-1-cyclopropyl-1,4-dihydro-8-Methyl-4-oxo-3-quinolinecarboxylic Acid
ethyl 6-chloro-2,3,4,9-tetrahydro-1h-carbazole-1-carboxylate
C15H16ClNO2 (277.08695059999997)
4-ALLYL-5-[(4-METHOXYPHENOXY)METHYL]-4H-1,2,4-TRIAZOLE-3-THIOL
(3-((3,4-Difluorophenyl)carbamoyl)phenyl)boronic acid
(R)-TERT-BUTYL 3-(BROMOMETHYL)PIPERIDINE-1-CARBOXYLATE
C11H20BrNO2 (277.06773200000003)
1,2,3,4-TETRAHYDRO-6-METHYL-4-(4-NITROPHENYL)-2-OXO-5-PYRIMIDINECARBOXYLIC ACID
1-(2-Methyl-3-nitrophenyl)-4-oxocyclohexanecarboxylic acid
1-CYCLOPROPYL-7-FLUORO-8-METHOXY-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID
4-[3-(3-Nitrophenyl)-1,2,4-oxadiazol-5-YL]butanoic acid
Levodopa-4-monophosphate
C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist
Durlobactam
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D065093 - beta-Lactamase Inhibitors C254 - Anti-Infective Agent > C258 - Antibiotic D004791 - Enzyme Inhibitors
(3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone
C13H8FNO5 (277.03864899999996)
2-chloro-N-(1-phenyl-3-propyl-1H-pyrazol-5-yl)acetamide
C14H16ClN3O (277.09818359999997)
2-amino-N-(4-ethylphenyl)-4-oxo-5,6-dihydro-4H-1,3-thiazine-6-carboxamide
3-(3,5-dimethoxyphenyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
ethyl 2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]acetate
N-(7-methyl-2-thiazolo[4,5-g][1,3]benzothiazolyl)propanamide
2-(5-Hydroxy-naphthalen-1-YL)-1,3-benzooxazol-6-OL
C17H11NO3 (277.07388960000003)
3-(6-Hydroxy-naphthalen-2-YL)-benzo[D]isooxazol-6-OL
C17H11NO3 (277.07388960000003)
(3R)-3-(aminomethyl)-9-methoxy-1,2,3,4-tetrahydro-5H-[1]benzothieno[3,2-e][1,4]diazepin-5-one
2-Hydroxy-5-(2-mercapto-ethylsulfamoyl)-benzoic acid
N-(1-Benzyl-3,3,3-trifluoro-2,2-dihydroxy-propyl)-acetamide
(alphaS)-alpha-Carboxy-2,3-dihydro-N,N,N-trimethyl-2-selenoxo-1H-imidazole-4-ethanaminium
4-Amino-5-(2,4-diamino-4-oxobutanoyl)peroxy-5-oxopentanoic acid
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-furancarboxamide
N-[4-cyano-2-(1-naphthalenyl)-5-oxazolyl]acetamide
3-[(6-Methoxy-4-methyl-2-quinolinyl)thio]propanoic acid
2-(4-Oxo-6,8-dioxabicyclo[3.2.1]octan-2-yl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
2,6-Dimethyl-4-(3-thienyl)pyridine-3,5-dicarboxylic acid
[methyl-oxo-[(1S)-1-[6-(trifluoromethyl)pyridin-3-yl]ethyl]-lambda6-sulfanylidene]cyanamide
C10H10F3N3OS (277.04966459999997)
2-Nitrobenzaldehyde (3-chloro-2-pyrazinyl)hydrazone
C11H8ClN5O2 (277.03664979999996)
[methyl-oxo-[(1R)-1-[6-(trifluoromethyl)pyridin-3-yl]ethyl]-lambda6-sulfanylidene]cyanamide
C10H10F3N3OS (277.04966459999997)
2-(p-Chlorophenyl)-3-ethyl-2,5-dihydro-5-oxo-4-pyridazinecarboxylate
C13H10ClN2O3- (277.03799200000003)
1-[(5S)-2,2-Dimethyl-5-(2-furanyl)oxazolidin-3-yl]-2,2-dichloroethanone
5-[(3-Methoxyphenyl)iminomethyl]-2,2-dimethyl-1,3-dioxane-4,6-dione
6-Amino-1-benzyl-3-methyl-5-(oxidoamino)-2-sulfanylidenepyrimidin-4-one
Neridronate
C78281 - Agent Affecting Musculoskeletal System > C67439 - Bone Resorption Inhibitor D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates
FENITROTHION
D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor D016573 - Agrochemicals
Selenoneine
A histidine derivative that is N(alpha),N(alpha),N(alpha)-trimethyl-L-histidine substituted by a selenoxo group at position 2 on the imidazole ring. A selenium-containing antioxidant found in tuna blood.
gamma-Glu-Met(1-)
A peptide anion obtained by deprotonation of both carboxy groups and protonation of the glutamyl amino group of gamma-Glu-Met. Major species at pH 7.3.
Oxazolidine, 3-(dichloroacetyl)-5-(2-furanyl)-2,2-dimethyl-, (5R)-
N-(2-methyl-3-chloro-4-hydroxyphenyl)anthranilic acid
Glucosamine (sulfate)
C6H15NO9S (277.04675000000003)
Glucosamine sulfate (D-Glucosamine sulfate) is an amino sugar and a prominent precursor in the biochemical synthesis of glycosylated proteins and lipids, is used as a dietary supplement. Glucosamine sulfate also is a natural constituent of glycosaminoglycans in the cartilage matrix and synovial fluid, which when administered exogenously, exerts pharmacological effects on osteoarthritic cartilage and chondrocytes[1]. Glucosamine sulfate (D-Glucosamine sulfate) is an amino sugar and a prominent precursor in the biochemical synthesis of glycosylated proteins and lipids, is used as a dietary supplement. Glucosamine sulfate also is a natural constituent of glycosaminoglycans in the cartilage matrix and synovial fluid, which when administered exogenously, exerts pharmacological effects on osteoarthritic cartilage and chondrocytes[1].
3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,11,14,16,18-heptaen-13-one
C17H11NO3 (277.07388960000003)
(2s)-2-[(2r)-4,7-dihydroxy-5-oxo-2h,3h-furo[2,3-f]isoindol-2-yl]propanoic acid
(5r,6r,10z)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
16-hydroxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,9(17),11,13-heptaene-8,15-dione
C17H11NO3 (277.07388960000003)
2-{4,7-dihydroxy-5-oxo-2h,3h-furo[2,3-f]isoindol-2-yl}propanoic acid
2-({2-carboxy-2-[(c-hydroxycarbonimidoylmethyl)amino]ethyl}amino)butanedioic acid
(8r,9s)-8,9-dihydroxy-7,7-dimethyl-1h,8h,9h-pyrano[2,3-g]indole-3-carboxylic acid
3,4-dihydroxy-5-methoxybenzoicacid methyl ester-4-sulfate
{"Ingredient_id": "HBIN007378","Ingredient_name": "3,4-dihydroxy-5-methoxybenzoicacid methyl ester-4-sulfate","Alias": "NA","Ingredient_formula": "C9H9O8S","Ingredient_Smile": "COC1=CC(=CC(=C1OS(=O)(=O)O)O)C(=O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15114","TCMID_id": "5963","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
9-hydroxy-8,11,19-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-1(19),2,4,6,8,13,15,17-octaen-12-one
(2-formyl-5-hydroxy-7-methoxy-1h-isoquinolin-1-yl)methyl acetate
(5r,6r,10e)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
(5r,6s,10e)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
8-hydroxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,8,11,13-heptaene-15,16-dione
C17H11NO3 (277.07388960000003)
[(1r)-2-formyl-5-hydroxy-7-methoxy-1h-isoquinolin-1-yl]methyl acetate
1-(2-imino-1h-pyrimidin-4-yl)pyrido[3,4-b]indol-9-ol
6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
(5s,6r,10z)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
6-hydroxy-2-methoxy-3-methylidene-10-[(1e)-prop-1-en-1-yl]-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
6-(1-hydroxyethyl)-7-oxo-3-sulfo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
(5r,6s,10z)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1,6,8(20),9,14,16,18-heptaen-13-one
C17H11NO3 (277.07388960000003)
8,9-dihydroxy-7,7-dimethyl-1h,8h,9h-pyrano[2,3-g]indole-3-carboxylic acid
(5s,6s,10z)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
(2s)-2-{[(2r)-2-carboxy-2-[(c-hydroxycarbonimidoylmethyl)amino]ethyl]amino}butanedioic acid
(6s,10z)-6-hydroxy-2-methoxy-3-methylidene-10-propylidene-2-azaspiro[4.5]dec-8-ene-1,4,7-trione
8-hydroxy-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one
(12s)-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1,6,8(20),9,14,16,18-heptaen-13-one
C17H11NO3 (277.07388960000003)
(2r)-2-[(2s)-4,7-dihydroxy-5-oxo-2h,3h-furo[2,3-f]isoindol-2-yl]propanoic acid
15-hydroxy-16-methoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-8-one
C17H11NO3 (277.07388960000003)