Exact Mass: 269.0776
Exact Mass Matches: 269.0776
Found 500 metabolites which its exact mass value is equals to given mass value 269.0776
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Acetochlor
CONFIDENCE standard compound; INTERNAL_ID 1174; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9499; ORIGINAL_PRECURSOR_SCAN_NO 9495 CONFIDENCE standard compound; INTERNAL_ID 1174; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9451; ORIGINAL_PRECURSOR_SCAN_NO 9447 CONFIDENCE standard compound; INTERNAL_ID 1174; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9445; ORIGINAL_PRECURSOR_SCAN_NO 9442 CONFIDENCE standard compound; INTERNAL_ID 1174; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9479; ORIGINAL_PRECURSOR_SCAN_NO 9474 CONFIDENCE standard compound; INTERNAL_ID 1174; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9585; ORIGINAL_PRECURSOR_SCAN_NO 9582 CONFIDENCE standard compound; INTERNAL_ID 1174; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9473; ORIGINAL_PRECURSOR_SCAN_NO 9469 CONFIDENCE standard compound; EAWAG_UCHEM_ID 104 CONFIDENCE standard compound; INTERNAL_ID 8482 CONFIDENCE standard compound; INTERNAL_ID 3221 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
Alachlor
CONFIDENCE standard compound; INTERNAL_ID 803; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9585; ORIGINAL_PRECURSOR_SCAN_NO 9582 CONFIDENCE standard compound; INTERNAL_ID 803; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9550; ORIGINAL_PRECURSOR_SCAN_NO 9545 CONFIDENCE standard compound; INTERNAL_ID 803; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9512; ORIGINAL_PRECURSOR_SCAN_NO 9510 CONFIDENCE standard compound; INTERNAL_ID 803; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9542; ORIGINAL_PRECURSOR_SCAN_NO 9539 CONFIDENCE standard compound; INTERNAL_ID 803; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9490; ORIGINAL_PRECURSOR_SCAN_NO 9488 CONFIDENCE standard compound; INTERNAL_ID 803; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9540; ORIGINAL_PRECURSOR_SCAN_NO 9537 Selective preemergent herbicide used on food crop CONFIDENCE standard compound; EAWAG_UCHEM_ID 274 CONFIDENCE standard compound; INTERNAL_ID 3225 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
Methyl red
D004396 - Coloring Agents CONFIDENCE standard compound; INTERNAL_ID 502; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9367; ORIGINAL_PRECURSOR_SCAN_NO 9363 CONFIDENCE standard compound; INTERNAL_ID 502; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9443; ORIGINAL_PRECURSOR_SCAN_NO 9441 CONFIDENCE standard compound; INTERNAL_ID 502; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9445; ORIGINAL_PRECURSOR_SCAN_NO 9443 CONFIDENCE standard compound; INTERNAL_ID 502; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9467; ORIGINAL_PRECURSOR_SCAN_NO 9462 CONFIDENCE standard compound; INTERNAL_ID 502; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9471; ORIGINAL_PRECURSOR_SCAN_NO 9469 CONFIDENCE standard compound; INTERNAL_ID 502; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9503; ORIGINAL_PRECURSOR_SCAN_NO 9501
2-(p-Methoxyphenyl)-3-(m-chlorophenyl)acrylonitrile
Disperse yellow 3
D004396 - Coloring Agents
Histidylasparagine
Histidylasparagine is a dipeptide composed of histidine and asparagine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Asparaginylhistidine
Asparaginylhistidine is a dipeptide composed of asparagine and histidine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Sulfamethoxazole N4-hydroxylamine
Sulfamethoxazole N4-hydroxylamine is a metabolite of Sulfamethoxazole. Sulfamethoxazole n4-hydroxylamine belongs to the family of Acyclic Alkanes. These are acyclic hydrocarbons consisting only of n carbon atoms and m hydrogen atoms where m=2*n + 2. D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
5-Hydroxysulfamethoxazole
5-Hydroxysulfamethoxazole belongs to the family of Aminophenol Derivatives. 5-Hydroxysulfamethoxazole is a metabolite of Sulfamethoxazole. Sulfamethoxazole (abbreviated SMZ or SMX) is a sulfonamide bacteriostatic antibiotic.
Tacedinaline
D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors C471 - Enzyme Inhibitor > C1946 - Histone Deacetylase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent D000970 - Antineoplastic Agents
2-Amino-6-chloro-9-(2,3-dideoxy-beta-D-glycero-pentofuranosyl)-9H-purine
4-[[4-(Dimethylamino)phenyl]diazenyl]benzoic acid
5-(2-Propoxyphenyl)-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
7,8-Dihydro-2'-deoxyguanosine
Alinidine
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
3-(5-Acetamido-2-hydroxyphenyl)sulfanyl-2-oxopropanoic acid
1,2-Disehydronorcoclaurine
1,2-disehydronorcoclaurine is a member of the class of compounds known as benzylisoquinolines. Benzylisoquinolines are organic compounds containing an isoquinoline to which a benzyl group is attached. 1,2-disehydronorcoclaurine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 1,2-disehydronorcoclaurine can be found in custard apple, which makes 1,2-disehydronorcoclaurine a potential biomarker for the consumption of this food product.
Histidinyl-Asparagine
4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-amine
2-Deoxyadenosine monohydrate
2'-Deoxyadenosine monohydrate is a deoxyribonucleoside. A building block in the chemical synthesis. 2'-Deoxyadenosine monohydrate is a deoxyribonucleoside. A building block in the chemical synthesis.
6-Me ether,O-Ac-1,6-Dihydroxy-3-methyl-9H-carbazole
9-methoxy-6,6a,11,11a-tetrahydrochromeno[4,3-b]indol-3-ol
Dichotomide VI
A beta-carboline alkaloid that is 9H-beta-carboline substituted by acetyl group at position 1, a hydroxy group at position 8 and an aminocarbonyl at position 3. It has been isolated from Stellaria dichotoma var. lanceolata.
2-(2-(2-aminoacetamido)-3-(1H-imidazol-4-yl) propanamido)acetic acid
Sulfamethoxazole N4-hydroxylamine
Asn-his
A dipeptide composed of L-asparagine and L-histidine joined by a peptide linkage.
3,4-DIHYDRO-2,2-DIOXO-7-METHOXYCARBONYL-1-METHYLBENZO[2,1-C]THIAZIN-4-ONE
ETHYL 2-CYANO-3-[4-(TRIFLUOROMETHYL)PHENYL]ACRYLATE
3-amino-6-methyl-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one
6-(CHLOROMETHYL)-4-(3-METHOXYPROPYL)-2H-BENZO[B][1,4]OXAZIN-3(4H)-ONE
1-(4-Piperidinyl)-2-(Trifluoromethyl)-1H-Benzimidazole
5-Methoxy-9-oxo-9,10-dihydroacridine-4-carboxylic acid
2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid
(+)-3-Hydroxy-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
3-(1H-BENZOIMIDAZOL-2-YL)-4,5,6,7-TETRAHYDRO-BENZO[B]THIOPHEN-2-YLAMINE
2-Chloro-6-methoxypyridine-4-boronic acid pinacol ester
3-BENZYL-1-ISOPROPYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBONITRILE
2-(2-pyridin-4-ylpyrrolidin-1-yl)pyridine-3-carboxylic acid
(4-(4-Chlorophenoxy)phenyl)methanamine hydrochloride
6-(1,2,3,4-Tetrahydro-1-isoquinolinyl)-1,3-benzodioxol-5-ol
2-(2-pyridin-3-ylpyrrolidin-1-yl)pyridine-3-carboxylic acid
tert-Butyl 4-chloro-5,6-dihydropyrido[3,4-d]pyrimidine-7(8H)-carboxylate
1,2,4-Triazolidine-3,5-dione,1,2,4-tris(2-oxiranylmethyl)-
2-(CHLOROACETYL)-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
1-(1H-Benzo[d]imidazol-2-yl)-3-methyl-4-oxo-1,4-dihydropyridine-2-carboxylic acid
1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 1-[(2-fluorophenyl)Methyl]-
4-(4,4-DIMETHYLPIPERIDIN-1-YL)BENZOIC ACID HYDROCHLORIDE
3-(ETHYLCARBAMOYL)-[1,1-BIPHENYL]-2-CARBOXYLIC ACID
2-(3-(METHYLCARBAMOYL)-[1,1-BIPHENYL]-3-YL)ACETIC ACID
2-(1-BENZYLPIPERIDIN-4-YL)ACETIC ACID HYDROCHLORIDE
6-(2,3-difluorophenyl)pyridine-2-carboximidamide,hydrochloride
4-chloro-5,8-dimethylquinoline-2-carboximidamide,hydrochloride
3-(4-METHYLPIPERAZIN-1-YL)-5-(METHYLSULFONYL)ANILINE
2′-Deoxy-2′-fluoroadenosine
2′-Deoxy-2′-fluoroadenosine can be used for the?synthesis?of 2′-Deoxy-2′-fluoro-modified oligonucleotides hybridized with RNA. 2′-Deoxy-2′-fluoroadenosine can be cleaved efficiently by E. coli purine nucleoside phosphorylase (PNP) to the toxic agent 2-fluoroadenine (FAde). 2′-Deoxy-2′-fluoroadenosine shows excellent in vivo activity against tumors expressing E. coli PNP[1].
3-isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-, 1,1-dimethylethyl ester, hydrochloride
5-Chloro-6-methoxypyridine-3-boronic acid pinacol ester
5-Chloro-2-methoxypyridine-3-boronic acid pinacol ester
2-((TERT-BUTYLDIMETHYLSILYLOXY)METHYL)-6-((TRIMETHYLSILYL)ETHYNYL)FURO[3,2-B]PYRIDINE
ETHYL 4-CHLORO-2-(PIPERIDIN-1-YL)PYRIMIDINE-5-CARBOXYLATE
METHYL 3-(PIPERIDIN-4-YLMETHYL)BENZOATE HYDROCHLORIDE
2-((TERT-BUTOXYCARBONYL)(3-FLUOROPHENYL)AMINO)ACETIC ACID
4-Thiazolidinecarboxylicacid, 2-(3,4-dimethoxyphenyl)-
3-BENZYL-5-(2-HYDROXYETHYL)-4-METHYLTHIAZOLIUM CHLORIDE
(4-((2,4-DIMETHYLPHENYL)CARBAMOYL)PHENYL)BORONIC ACID
(4-Chloro-3-(morpholine-4-carbonyl)phenyl)boronic acid
2-methyl-5-(pyrrolidin-1-ylsulfonyl)phenylboronic acid
METHYL 2-AMINO-2-(4-(TRIFLUOROMETHYL)PHENYL)ACETATE HYDROCHLORIDE
(S)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOIC ACID HYDROCHLORIDE
tert-Butyl 4-(thiazol-2-yl)piperazine-1-carboxylate
4-methyl-N-(4-methylpiperazin-1-yl)benzenesulfonamide
(3-Chloro-5-(morpholine-4-carbonyl)phenyl)boronic acid
tert-butyl 3-chloro-7,8-dihydro-5H-pyrido[4,3-c]pyridazine-6-carboxylate
METHYL 7-CHLORO-2-METHYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLATE
6-(BETA-D-2-DEOXYRIBOFURANOSYL)-3,4-DIHYDRO-8H-PYRIMIDO-[4,5-C][1,2]OXAZIN-7-ONE
para-anisaldehyde / methyl anthranilate schiffs base
Propatyl nitrate
C - Cardiovascular system > C01 - Cardiac therapy > C01D - Vasodilators used in cardiac diseases > C01DA - Organic nitrates C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent
3-Chloro-2-methoxypyridine-4-boronic acid pinacol ester
Dexmethylphenidate hydrochloride
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators
Oncrasin-1
Oncrasin-1 is a highly effective anti-cancer inhibitor that can kill various K-Ras mutant human lung cancer cells at low concentrations.
3-Hydroxy-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
(2,4-Dioxo-1,2,3,4-tetrahydro-pyrimidin-5-ylamino)-fumaric acid dimethyl ester
METHYL 4-(4-OXO-4,7-DIHYDRO-3H-PYRROLO[2,3-D]PYRIMIDIN-6-YL)BENZOATE
Methanesulfonic acid, 1,1,1-trifluoro-, 4-[(1R)-1-aminoethyl]phenyl ester
3-[(4-chlorophenoxy)methyl]-4-ethyl-1H-1,2,4-triazole-5-thione
5-(((5-(TERT-BUTYL)OXAZOL-2-YL)METHYL)THIO)THIAZOL-2-AMINE
6-Chloro-2-methoxypyridine-3-boronic acid pinacol ester
2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxylic acid
5-Chloro-2-(morpholine-4-carbonyl)phenylboronic acid
(1-(tert-Butoxycarbonyl)-5-(methoxycarbonyl)-1H-pyrrol-2-yl)boronic acid
6-AMINO-2-([(2,3-DIFLUOROPHENYL)METHYL]SULFANYL)-3,4-DIHYDROPYRIMIDIN-4-ONE
4-[(1,1-Dioxo-1lambda~6~,4-thiazinan-4-yl)-methyl]benzenecarboxylic acid
[3-(4-methylpiperazin-1-yl)sulfonylphenyl]methanamine
1-(2-METHOXYETHYL)-7-(METHYLTHIO)-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE
tert-Butyl 4-chloro-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
(R)-3-AMINO-4-(2,4,5-TRIFLUOROPHENYL)BUTANOIC ACID HYDROCHLORIDE
4-Quinolinecarboxylic acid, 2-(trifluoromethyl)-, ethyl ester
Ethyl 5-chloro-6-piperazin-1-ylpyridine-3-carboxylate
2-BENZYLAMINO-CYCLOHEXANECARBOXYLIC ACID HYDROCHLORIDE
(2R,3R,5S)-2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolan-3-ol
Methyl 4-acetamido-5-chloro-2,3-dihydrobenzofuran-7-carboxylate
(3-CHLORO-4-(MORPHOLINE-4-CARBONYL)PHENYL)BORONIC ACID
(S)-(+)-5-(Hydroxymethyl)-2-pyrrolidinone p-toluenesulfonate
2-pyridin-2-yl-4-(trifluoromethyl)pyrimidine-5-carboxylic acid
1-(5-bromo-4-methylpyridin-2-yl)-4-methylpiperazine
[3-[(2,4-dimethylphenyl)carbamoyl]phenyl]boronic acid
[3-[(2,3-dimethylphenyl)carbamoyl]phenyl]boronic acid
Methyl 3-(2-amino-4-pyrimidinyl)-1H-pyrrolo[2,3-b]pyridine-4-carb oxylate
2-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
3-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine hydrochloride
1-(benzo[d][1,3]dioxol-5-yl)-2-(6-Methylpyridin-2-yl)ethane-1,2-dione
benzyl-dimethyl-(2-prop-2-enoyloxyethyl)azanium,chloride
tert-butyl 2-(hydroxymethyl)-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxylate
(S)-1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXYLIC ACIDT-BUTYL ESTER
N-Methyl-2-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzylamine
1H-INDAZOLE, 6-FLUORO-1-METHYL-3-(4-PIPERIDINYL)-, HYDROCHLORIDE
(6-[4-(TRIFLUOROMETHOXY)PHENYL]PYRIDIN-3-YL)METHANOL
tert-Butyl (2-amino-4,5,6,7-tetrahydrobenzo[d]thiazol-6-yl)carbamate
Benzenamine, 3-[[4-(methylsulfonyl)-1-piperazinyl]methyl]-
3-(6-Hydroxybenzodioxol-5-yl)-1,3-dihydro-2H-indol-2-one
tert-butyl 2-chloro-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxylate
methylphenidate hydrochloride
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators
METHYL 5-(ACETYLOXY)-4-(2-METHOXY-2-OXOETHYL)-2-METHYL-1H-PYRROLE-3-CARBOXYLATE
1-(5-CHLORO-METHOXYPHENYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID
Phenol,4-[(E)-[(4-methoxyphenyl)methylene]amino]-, 1-acetate
(S)-Tert-Butyl2-(2-aminothiazol-4-yl)pyrrolidine-1-carboxylate
3-ISOQUINOLINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-, 1,1-DIMETHYLETHYL ESTER, HYDROCHLORIDE, (S)-
(2R,3R)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)- 2,3-Butanediol
1-(2,1,3-Benzothiadiazol-5-yl)-2-(6-Methyl-2-pyridinyl)ethanone
methacryloyl oxyethyl dimethylbenzyl ammonium chloride
methyl 2-fluoro-4-((1-methoxy-2-methyl-1-oxopropan-2-yl)amino)benzoate
1-Methyl-5-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxylic Acid
2-Aminopurine-9-beta-D-(2-deoxy-2-fluoro)arabino-riboside
(R)-2-(2-Fluoro-5-(trifluoromethyl)phenyl)pyrrolidine hydrochloride
1-(3-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide
(4S)-2-(3,5-Dimethoxyphenyl)-1,3-thiazolidine-4-carboxylic acid
(4-Methyl-3-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid
1-(2,4-DICHLORO-BENZYL)-3,5-DIMETHYL-1H-PYRAZOL-4-YLAMINE
2-chloro-3-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
ethyl 1-(6-chloropyridazin-3-yl)piperidine-4-carboxylate
N4-Acetyl-2-deoxycytidine
N-Acetyl-2′-deoxycytidine is a purine nucleoside analog. 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].
4-thiophen-2-yl-4,10-dihydro-[1,3,5]triazino[1,2-a]benzimidazol-2-amine
2-(3-(METHYLCARBAMOYL)-[1,1-BIPHENYL]-4-YL)ACETIC ACID
1-(3-CHLORO-4-METHOXYPHENYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID
2-NITRO-ALPHA-[(2,2,2-TRIFLUOROETHOXY)METHYL]-IMIDAZOLE-1-ETHANOL
METHYL 4-AMINO-5-BROMO-2-METHOXYBENZENECARBOXYLATE
(2-Methyl-4-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid
9-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)adenine
3-(4-chlorophenyl)-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione
5-(Furan-2-yl)-3-p-tolyl-4,5-dihydro-1H-pyrazole-1-carboxamide
1-(5-BROMO-PYRIDIN-2-YL)-PYRROLIDIN-3-YL]-DIMETHYLAMINE
ethyl 2-[tert-butoxycarbonylimino]-3,3,3-trifluoro-propionate
2-AMINO-6-BENZYL-4,5,6,7-TETRAHYDRO-THIENO[2,3-C]PYRIDINE-3-CARBONITRILE
4-(4-nitrophenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
(4-((1H-Tetrazol-5-yl)carbamoyl)phenyl)boronic acid hydrochloride
(3-((1H-TETRAZOL-5-YL)CARBAMOYL)PHENYL)BORONIC ACID HYDROCHLORIDE
Methyl 4-hydroxy-2-methyl-(2H)-1,2-benzothiazine-3-carboxylate-1,1-dioxide
2-THIOPHEN-2-YL-QUINOLINE-4-CARBOXYLICACIDHYDRAZIDE
2-Chlorodideoxyadenosine
D009676 - Noxae > D000963 - Antimetabolites > D015224 - Dideoxynucleosides
Pardoprunox hydrochloride
C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist Pardoprunox (SLV-308) hydrochloride is a partial dopamine D2 and D3 receptor partial agonist and a serotonin 5-HT1A receptor agonist, with pEC50s of 8, 9.2, and 6.3, respectively[1].
5-(2-Propoxyphenyl)-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
N-Benzoyl-D-phenylalanine
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D000345 - Affinity Labels
4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazole-3-thiol
2-(4-Methylanilino)-4-pyrido[3,2-e][1,3]thiazinone
4-Amino-1-[(1s,3r,4r,7s)-7-Hydroxy-1-(Hydroxymethyl)-2,5-Dioxabicyclo[2.2.1]Hept-3-Yl]-5-Methylpyrimidin-2(1h)-One
5-Methyl-2'-O,4'-C-methylenecytidine is a cytidine nucleoside analog. Cytidine analogs have a mechanism of inhibiting DNA methyltransferases (such as Zebularine, HY-13420), and have potential anti-metabolic and anti-tumor activities[1].
(1E,4E)-1-(2,4-dichlorophenyl)-5-(dimethylamino)penta-1,4-dien-3-one
2-Methyl-3-(thiophene-2-carbonyl)-indolizine-1-carbaldehyde
2-(2-Chloro-3-pyridinyl)-1-prop-2-enylbenzimidazole
1-Phenyl-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethanone
2-Chloro-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
alpha-(p-Methoxyphenyl)-6-methyl-2-pyridineacrylic acid
(1R,2R,3R,4S,5R)-4-(Benzylamino)-5-(methylthio)cyclopentane-1,2,3-triol
(2R)-4,4-dihydroxy-5-nitro-2-(phenylmethyl)pentanoic acid
CI-994
D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors C471 - Enzyme Inhibitor > C1946 - Histone Deacetylase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent D000970 - Antineoplastic Agents
6-methoxy-4-methylbenzo[g]quinoline-2,5,10(1H)-trione
A natural product found in Annona glabra.
Emodin(1-)
A phenolate anion that is the conjugate base of emodin, obtained by deprotonation of the phenolic hydroxy group at position 2; major species at pH 7.3 (according to Marvin v 6.2.0.).
Genistein(1-)
An organic anion that is the conjugate base of genistein, obtained by selective deprotonation of the 7-hydroxy group.
(2S)-2-amino-5-[[(2S)-1-hydroxy-3-[(1S)-2-methylidenecyclopropyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
(2R,3S,4R,5S)-2-(7-amino-2,3-dihydro-1H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
(4R)-10,11-dihydroxy-5-azaspiro[cyclohexane-1,2-tricyclo[6.3.1.04,12dodecane]-(12),2,5,8,10-pentaen-4-one
(2S)-2,5-diamino-4-[(2-phosphonoacetyl)amino]pentanoic acid
2-Amino-9-(2,3-dideoxy-3-fluoropentofuranosyl)-3,9-dihydro-6H-purin-6-one
2-amino-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-1H-purin-6-one
N-Benzoyl-L-phenylalanine
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D000345 - Affinity Labels
Concerta
D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators
Baicalein(1-)
A flavonoid oxoanion obtained by deprotonation of the hydroxy group at position 7 of baicalein. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Acetic acid [4-[(1-oxo-2-phenylethyl)amino]phenyl] ester
4-(3-Methyl-5-isoxazolyl)-5-phenylcyclohexane-1,3-dione
5-(2-furanyl)-N-(3-pyridinylmethyl)-3-isoxazolecarboxamide
2-[(pyridin-2-ylsulfanyl)methyl]quinazolin-4(1H)-one
4-Oxo-4-thiophen-2-ylbutanoic acid [2-(ethylamino)-2-oxoethyl] ester
3-Methyl-2-thiophenecarboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester
2-Thiophenecarboxylic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester
2-phenoxy-N-[(1E)-pyridin-2-ylmethylene]propanohydrazide
2-(2-methylphenoxy)-N-[(1E)-pyridin-2-ylmethylene]acetohydrazide
2-[(prop-2-enylthio)-(4,5,6,7-tetrahydro-1H-indol-2-yl)methylidene]propanedinitrile
(2Z)-2-(1-butyl-2-oxoindol-3-ylidene)-2-cyanoacetamide
5-Isocyano-2-[[2-(methylaminomethyl)phenyl]thio]aniline
1-[(Z)-[(4-amino-1,2,5-oxadiazol-3-yl)hydrazinylidene]methyl]naphthalen-2-ol
(2R)-2-acetamido-3-[(R)-benzylsulfinyl]propanoic acid
sulfamethoxazole hydroxylamine
A sulfonamide compound having a 4-hydroxylaminophenyl group attached to the sulfur atom and a 1,2-oxazol-3-yl group attached to the nitrogen atom. D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
alpha-(4-methoxyphenyl)-6-methyl-2-pyridineacrylic acid
A monocarboxylic acid that is acrylic acid with substituents 4-methoxyphenyl at position 2 and 6-methylpyridin-2-yl at position 3.
pelargonidin(1-)
An organic anion obtained by selective deprotonation of the 3- and 5-hydroxy groups of pelargonidin; major species at pH 7.3.
nataloe-emodin(1-)
A phenolate anion that is the conjugate base of nataloe-emodin, obtained by deprotonation of the phenolic hydroxy group at position 2. Major species at pH 7.3.
baeocystin(1-)
An organophosphate oxoanion obtained by deprotonation of the phosphate and protonation of the amino group of baeocystin; major species at pH 7.3.
3'-Azido-3'-deoxy-beta-L-uridine
3'-Azido-3'-deoxy-beta-L-uridine (Compound 25) is a nucleoside derivative. 3'-Azido-3'-deoxy-beta-L-uridine is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. Strain-promoted alkyne-azide cycloaddition (SPAAC) can also occur with molecules containing DBCO or BCN groups.
3'-Deoxy-3'-fluoroadenosine
3'-Deoxy-3'-fluoroadenosine 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].
Piperoxan (hydrochloride)
Piperoxan (Benodaine) hydrochloride is an α2 adrenoceptor antagonist. Piperoxan hydrochloride is the first-generation antihistamine.
(1s,2r)-1-[5-(3-chloro-4-hydroxyphenyl)-1,3-oxazol-2-yl]propane-1,2-diol
methyl 2-(2-hydroxyphenyl)-1,3-benzoxazole-4-carboxylate
methyl 10-hydroxy-2-oxa-9-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,9,11,13-heptaene-7-carboxylate
(14s)-14-methoxy-8-oxa-17-azatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(10),2,4,6,11(15),16-hexaen-4-ol
apohaemanthamine
{"Ingredient_id": "HBIN016512","Ingredient_name": "apohaemanthamine","Alias": "NA","Ingredient_formula": "C16H15NO3","Ingredient_Smile": "C1C2C=CC34C1N(CC3O2)CC5=CC6=C(C=C45)OCO6","Ingredient_weight": "269.29 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1532","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "70693230","DrugBank_id": "NA"}