Exact Mass: 252.0859

Exact Mass Matches: 252.0859

Found 500 metabolites which its exact mass value is equals to given mass value 252.0859, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Benzo[a]pyrene

pentacyclo[10.6.2.0^{2,7}.0^{9,19}.0^{16,20}]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene

C20H12 (252.0939)


Benzo[a]pyrene appears as a liquid. Presents a threat to the environment. Immediate steps should be taken to limits its spread to the environment. Easily penetrates the soil and contaminates groundwater or nearby waterways. Benzo[a]pyrene is an ortho- and peri-fused polycyclic arene consisting of five fused benzene rings. It has a role as a carcinogenic agent and a mouse metabolite. Benzo[a]pyrene is a natural product found in Angelica sinensis and Homo sapiens with data available. 3,4-Benzpyrene is a crystalline, aromatic hydrocarbon consisting of five fused benzene rings and formed during the incomplete combustion of organic matter. 3,4-Benzpyrene is primarily found in gasoline and diesel exhaust, cigarette smoke, coal tar and coal tar pitch, charcoal-broiled foods and certain other foods, amino acids, fatty acids and carbohydrate pyrolysis products, soot smoke, creosote oil, petroleum asphalt and shale oils. This substance is used only for research purposes. 3,4-Benzpyrene is reasonably anticipated to be a human carcinogen. (NCI05) Benzo[a]pyrene is one of over 100 different polycyclic aromatic hydrocarbons (PAHs). PAHs are chemicals that are formed during the incomplete burning organic substances, such as fossil fuels. They are usually found as a mixture containing two or more of these compounds. It is one ingredient of cigarette. (L10) A potent mutagen and carcinogen. It is a public health concern because of its possible effects on industrial workers, as an environmental pollutant, an as a component of tobacco smoke. See also: Tobacco Leaf (part of) ... View More ... Benzo[a]pyrene, also known as 3,4-Benzopyrene or 3,4-BP, is classified as a member of the Benzopyrenes. Benzopyrenes are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system. Benzo[a]pyrene is formally rated as a carcinogenic (IARC 1) potentially toxic compound. Benzo[a]pyrene is a crystalline, aromatic hydrocarbon consisting of five fused benzene rings and formed during the incomplete combustion of organic matter. Benzo[a]pyrene is primarily found in gasoline and diesel exhaust, cigarette smoke, coal tar and coal tar pitch, charcoal-broiled foods and certain other foods, amino acids, fatty acids and carbohydrate pyrolysis products, soot smoke, creosote oil, petroleum asphalt and shale oils. This substance is used only for research purposes. Benzo[a]pyrene is reasonably anticipated to be a human carcinogen (NCI05). Its diol epoxide metabolites (more commonly known as BPDE) react and bind to DNA, resulting in mutations and eventually cancer. It is listed as a Group 1 carcinogen by the IARC. In the 18th century a scrotal cancer of chimney sweepers, the chimney sweeps carcinoma, was already connected to soot. [Wikipedia] An ortho- and peri-fused polycyclic arene consisting of five fused benzene rings. Benzo[a]pyrene shows lung carcinogenicity in animal models, and it is frequently used in chemoprevention studies. Benzo[a]pyrene shows lung carcinogenicity in animal models, and it is frequently used in chemoprevention studies.

   

Trinexapac-ethyl

Ethyl (RS)-4-cyclopropyl(hydroxy)methylene-3,5-dioxocyclohexanecarboxylic acid

C13H16O5 (252.0998)


   

Oxcarbazepine

9-oxo-2-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaene-2-carboxamide

C15H12N2O2 (252.0899)


Oxcarbazepine is structurally a derivative of carbamazepine, adding an extra oxygen atom to the benzylcarboxamide group. This difference helps reduce the impact on the liver of metabolizing the drug, and also prevents the serious forms of anemia occasionally associated with carbamazepine. Aside from this reduction in side effects, it is thought to have the same mechanism as carbamazepine - sodium channel inhibition - and is generally used to treat partial seizures in epileptic children and adults. D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AF - Carboxamide derivatives D065693 - Cytochrome P-450 Enzyme Inducers > D065701 - Cytochrome P-450 CYP3A Inducers C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D049990 - Membrane Transport Modulators

   

Carbamazepine-10,11-epoxide

3-oxa-11-azatetracyclo[10.4.0.0²,⁴.0⁵,¹⁰]hexadeca-1(16),5,7,9,12,14-hexaene-11-carboxamide

C15H12N2O2 (252.0899)


Carbamazepine-10,11-epoxide is a metabolite of carbamazepine. Carbamazepine (CBZ) is an anticonvulsant and mood-stabilizing drug used primarily in the treatment of epilepsy and bipolar disorder, as well as trigeminal neuralgia. (Wikipedia) CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 1073 CONFIDENCE standard compound; EAWAG_UCHEM_ID 916 CONFIDENCE standard compound; INTERNAL_ID 2038

   

Deoxyinosine

9-(2-Deoxy-beta-delta-erythro-pentofuranosyl)-1,9-dihydro-6H-purin-6-one

C10H12N4O4 (252.0859)


Deoxyinosine is a nucleoside that is formed when hypoxanthine is attached to a deoxyribose ring (also known as a ribofuranose) via a beta-N9-glycosidic bond. Deoxyinosine is found in DNA while inosine is found in RNA. Inosine is a nucleic acid important for RNA editing. Adenosine deaminase (ADA) catalyzes the conversion of adenosine and deoxyadenosine to inosine and deoxyinosine, respectively. ADA-deficient individuals suffer from severe combined immunodeficiency (SCID) and are unable to produce significant numbers of mature T or B lymphocytes. This occurs as a consequence of the accumulation of ADA substrates or their metabolites. Inosine is also an intermediate in a chain of purine nucleotides reactions required for muscle movements. Moreover, deoxyinosine is found to be associated with purine nucleoside phosphorylase (PNP) deficiency, which is an inborn error of metabolism. Isolated from Phaseolus vulgaris (kidney bean). 2-Deoxyinosine is found in pulses, yellow wax bean, and green bean. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS 2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency. 2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency.

   

Phenytoin

5,5-Diphenyltetrahydro-1H-2,4-imidazoledione

C15H12N2O2 (252.0899)


An anticonvulsant that is used in a wide variety of seizures. It is also an anti-arrhythmic and a muscle relaxant. The mechanism of therapeutic action is not clear, although several cellular actions have been described including effects on ion channels, active transport, and general membrane stabilization. The mechanism of its muscle relaxant effect appears to involve a reduction in the sensitivity of muscle spindles to stretch. Phenytoin has been proposed for several other therapeutic uses, but its use has been limited by its many adverse effects and interactions with other drugs. [PubChem] CONFIDENCE standard compound; INTERNAL_ID 827; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3943; ORIGINAL_PRECURSOR_SCAN_NO 3941 CONFIDENCE standard compound; INTERNAL_ID 920; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3971; ORIGINAL_PRECURSOR_SCAN_NO 3969 CONFIDENCE standard compound; INTERNAL_ID 920; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3970; ORIGINAL_PRECURSOR_SCAN_NO 3969 CONFIDENCE standard compound; INTERNAL_ID 827; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3970; ORIGINAL_PRECURSOR_SCAN_NO 3969 CONFIDENCE standard compound; INTERNAL_ID 920; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3951; ORIGINAL_PRECURSOR_SCAN_NO 3950 CONFIDENCE standard compound; INTERNAL_ID 920; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3943; ORIGINAL_PRECURSOR_SCAN_NO 3941 CONFIDENCE standard compound; INTERNAL_ID 827; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3985; ORIGINAL_PRECURSOR_SCAN_NO 3983 CONFIDENCE standard compound; INTERNAL_ID 827; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3971; ORIGINAL_PRECURSOR_SCAN_NO 3969 CONFIDENCE standard compound; INTERNAL_ID 827; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3951; ORIGINAL_PRECURSOR_SCAN_NO 3950 CONFIDENCE standard compound; INTERNAL_ID 920; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3953; ORIGINAL_PRECURSOR_SCAN_NO 3948 CONFIDENCE standard compound; INTERNAL_ID 827; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3953; ORIGINAL_PRECURSOR_SCAN_NO 3948 CONFIDENCE standard compound; INTERNAL_ID 920; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3985; ORIGINAL_PRECURSOR_SCAN_NO 3983 D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AB - Hydantoin derivatives D065693 - Cytochrome P-450 Enzyme Inducers > D065694 - Cytochrome P-450 CYP1A2 Inducers C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants CONFIDENCE standard compound; EAWAG_UCHEM_ID 3319 D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker

   

Benzo[b]fluoranthene

pentacyclo[10.7.1.0²,⁷.0⁸,²⁰.0¹³,¹⁸]icosa-1(19),2,4,6,8(20),9,11,13,15,17-decaene

C20H12 (252.0939)


   

Benzo[k]fluoranthene

pentacyclo[10.7.1.0^{2,11}.0^{4,9}.0^{16,20}]icosa-1(19),2,4,6,8,10,12,14,16(20),17-decaene

C20H12 (252.0939)


   

Nebularine

2-(hydroxymethyl)-5-(9H-purin-9-yl)oxolane-3,4-diol

C10H12N4O4 (252.0859)


Nebularine, also known as purine riboside is found in mushrooms. Nebularine can be isolated from the mushroom Clitocybe nebularis (clouded agaric). Nebularine is a nucleoside analog that is used in a variety of enzyme studies. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D000970 - Antineoplastic Agents KEIO_ID P081; [MS2] KO009216 KEIO_ID P081

   

2-Hydroxycarbamazepine

2-Hydroxycarbamazepine

C15H12N2O2 (252.0899)


CONFIDENCE standard compound; INTERNAL_ID 4111 CONFIDENCE standard compound; INTERNAL_ID 2347

   

7-methoxyisoflavone

7-methoxyisoflavone

C16H12O3 (252.0786)


A methoxyisoflavone that is isoflavone substituted by a methoxy group at position 7. relative retention time with respect to 9-anthracene Carboxylic Acid is 1.174 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.177 7-Methoxyisoflavone is an isoflavone derivative and also an activator of adenosine monophosphate-activated protein kinase (AMPK).

   

Cycasin

(Z)-methyl-oxido-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethylimino]azanium

C8H16N2O7 (252.0957)


Cycasin is an alkaloid from seeds of the false sago Cycas circinalis and sago cycas Cycas revoluta (Cycadaceae). Carcinogen of significance in human nutrition; but in practice the toxin is present in the seeds of the plant and the pith is used as a food source. Isolated from human milk D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009498 - Neurotoxins

   

4-O-Methylisoflavone

4-O-Methylisoflavone

C16H12O3 (252.0786)


A methoxyisoflavone that is isoflavone substituted by a methoxy group at position 4.

   

5-Hydroxy-N-formylkynurenine

2-amino-4-(2-formamido-5-hydroxyphenyl)-4-oxobutanoic acid

C11H12N2O5 (252.0746)


5-Hydroxy-N-formylkynurenine is an intermediate in tryptophan metabolism. 5-Hydroxy-N-formylkynurenine is converted from 5-Hydroxy-L-tryptophan via the enzyme, indoleamine 2,3-dioxygenase [EC:1.13.11.52]. [HMDB] 5-Hydroxy-N-formylkynurenine is an intermediate in tryptophan metabolism. 5-Hydroxy-N-formylkynurenine is converted from 5-Hydroxy-L-tryptophan via the enzyme, indoleamine 2,3-dioxygenase [EC:1.13.11.52].

   

Benzo[e]pyrene

pentacyclo[10.6.2.0^{2,7}.0^{8,20}.0^{15,19}]icosa-1(18),2,4,6,8,10,12(20),13,15(19),16-decaene

C20H12 (252.0939)


   

UNII-CT7Y6SZA5M

1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]ethanone

C16H12O3 (252.0786)


   

3-Hydroxycarbamazepine

5-hydroxy-2-azatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,9,11,13-heptaene-2-carboxamide

C15H12N2O2 (252.0899)


3-Hydroxycarbamazepine is a metabolite of carbamazepine. Carbamazepine (CBZ) is an anticonvulsant and mood-stabilizing drug used primarily in the treatment of epilepsy and bipolar disorder, as well as trigeminal neuralgia. (Wikipedia)

   

Benz(j)aceanthrylene

Benz(j)aceanthrylene

C20H12 (252.0939)


   

Benz[j]fluoranthene

7,8-Benzfluoranthene

C20H12 (252.0939)


   

Benz(l)aceanthrylene

Benz(l)aceanthrylene

C20H12 (252.0939)


   

BENZO(A)FLUORANTHENE

Benzo[a]aceanthrylene

C20H12 (252.0939)


   

Perylene

Dibenz[de,KL]anthracene

C20H12 (252.0939)


   

Anatoxin a(s)

Phosphoric acid, mono[(5S)-2-amino-5-[(dimethylamino)methyl]-4,5-dihydro-1H-imidazol-1-yl] monomethyl ester

C7H17N4O4P (252.0987)


   

grandinol

2,4,6-Trihydroxy-3-methyl-5-(3-methylbutanoyl)benzaldehyde

C13H16O5 (252.0998)


   

3-Methoxyflavone

3-Methoxyflavone

C16H12O3 (252.0786)


The parent member of the class of 3-methoxyflavones that is flavone which carries a methoxy group at the 3-position.

   

5-Deoxyinosine

5-Deoxyinosine

C10H12N4O4 (252.0859)


A 5-deoxyribonucleoside in which hypoxanthine is attached to 5-deoxyribofuranose via a beta-N(9)-glycosidic bond.

   

Purine nucleoside

Purine nucleoside

C10H12N4O4 (252.0859)


   

Methyl 3,4,5-trimethoxycinnamate

2-Propenoic acid, 3-(3,4,5-trimethoxyphenyl)-, methyl ester, (2E)-

C13H16O5 (252.0998)


Methyl-3,4,5-trimethoxy cinnamate is an alkyl cinnamate obtained by the formal condensation of the carboxy group of 3,4,5-trimethoxycinnamic acid with methanol. It is a member of methoxybenzenes and an alkyl cinnamate. Methyl 3,4,5-trimethoxycinnamate is a natural product found in Hedysarum polybotrys, Piper arborescens, and other organisms with data available. Methyl 3,4,5-trimethoxycinnamate is found in herbs and spices. Methyl 3,4,5-trimethoxycinnamate is isolated from Piper longum (long pepper) and other plant species. Isolated from Piper longum (long pepper) and other plant subspecies Methyl 3,4,5-trimethoxycinnamate is found in herbs and spices.

   

1-(2,4,6-Trimethoxyphenyl)-1,3-butanedione

1-(2,4,6-Trimethoxyphenyl)-1,3-butanedione

C13H16O5 (252.0998)


1-(2,4,6-Trimethoxyphenyl)-1,3-butanedione is found in herbs and spices. 1-(2,4,6-Trimethoxyphenyl)-1,3-butanedione is a constituent of Eugenia caryophyllata (clove) oil

   

Pterosin J

6-(2-Chloroethyl)-2,3-dihydro-3-hydroxy-2,5,7-trimethyl-1H-inden-1-one

C14H17ClO2 (252.0917)


Isolated from Pteridium aquilinum (bracken fern). Pterosin J is found in green vegetables and root vegetables. Pterosin J is found in green vegetables. Pterosin J is isolated from Pteridium aquilinum (bracken fern).

   

7-Hydroxy-2-methylisoflavone

7-Hydroxy-2-methyl-3-phenyl-4H-1-benzopyran-4-one, 9ci

C16H12O3 (252.0786)


7-Hydroxy-2-methylisoflavone is found in herbs and spices. 7-Hydroxy-2-methylisoflavone is isolated from roots of Glycyrrhiza glabra (licorice). Isolated from roots of Glycyrrhiza glabra (licorice). 7-Hydroxy-2-methylisoflavone is found in tea and herbs and spices.

   

Methylhalfordinol

3-[5-(4-Methoxyphenyl)-2-oxazolyl]pyridine, 9ci

C15H12N2O2 (252.0899)


Methylhalfordinol is found in fruits. Methylhalfordinol is an alkaloid from ripe fruits of Aegle marmelos (bael fruit) and the aerial parts of Triphasia trifolia (limeberry). Alkaloid from ripe fruits of Aegle marmelos (bael fruit) and the aerial parts of Triphasia trifolia (limeberry). Methylhalfordinol is found in fruits.

   

Anisindione

2-(4-methoxyphenyl)-2,3-dihydro-1H-indene-1,3-dione

C16H12O3 (252.0786)


Anisindione is a synthetic anticoagulant and an indanedione derivative. It prevents the formation of active procoagulation factors II, VII, IX, and X, as well as the anticoagulant proteins C and S, in the liver by inhibiting the vitamin K-mediated gamma-carboxylation of precursor proteins. C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent

   

N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine

2-Amino-4-[(3,4-dioxocyclohexa-1,5-dien-1-yl)-C-hydroxycarbonimidoyl]butanoate

C11H12N2O5 (252.0746)


N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine is found in mushrooms. N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine is isolated from the mushroom Agaricus bisporus (button mushroom Isolated from the mushroom Agaricus bisporus (button mushroom). N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine is found in mushrooms.

   

4-Hydroxyvalerylcarnitine

({3-carboxy-2-[(4-hydroxypentanoyl)oxy]propyl}dimethylazaniumyl)methylidyne

C12H14NO5 (252.0872)


4-Hydroxyvalerylcarnitine is an acylcarnitine. More specifically, it is an 4-hydroxypentanoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. 4-Hydroxyvalerylcarnitine is therefore classified as a short chain AC. As a short-chain acylcarnitine 4-Hydroxyvalerylcarnitine is a member of the most abundant group of carnitines in the body, comprising more than 50\\% of all acylcarnitines quantified in tissues and biofluids (PMID: 31920980). Some short-chain carnitines have been studied as supplements or treatments for a number of diseases, including neurological disorders and inborn errors of metabolism. In particular 4-Hydroxyvalerylcarnitine is elevated in the blood or plasma of individuals with 3-hydroxy-3-methylglutaryl-coenzyme A lyase deficiency (PMID: 28583327) and holocarboxylase synthetase deficiency (PMID: 27114915). It is also decreased in the blood or plasma of individuals with psoriasis (PMID: 33391503). Carnitine acetyltransferase (CrAT, EC:2.3.1.7) is responsible for the synthesis of all short-chain and short branched-chain acylcarnitines (PMID: 23485643). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

4-(3-Phosphonopropyl)piperazine-2-carboxylic acid

3-(2-Carboxypiperazin-4-yl)propyl-1-phosphonic acid

C8H17N2O5P (252.0875)


   

2-Benzoyloxycinnamaldehyde

2-(3-Oxoprop-1-en-1-yl)phenyl benzoic acid

C16H12O3 (252.0786)


   

2-(Trifluoromethyl)benzhydrol

phenyl[2-(trifluoromethyl)phenyl]methanol

C14H11F3O (252.0762)


   

3-Phenoxypropylene di(acetate)

1-(Acetyloxy)-3-phenoxypropan-2-yl acetic acid

C13H16O5 (252.0998)


   

3'-Deoxyinosine

9-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-1H-purin-6-one

C10H12N4O4 (252.0859)


   

N-[1-(Hydroxymethyl)-2-(4-nitrophenyl)-2-oxoethyl]acetamide

N-[1-(Hydroxymethyl)-2-(4-nitrophenyl)-2-oxoethyl]acetamide

C11H12N2O5 (252.0746)


   

5-Ethynyl-2'-deoxyuridine

5-ethynyl-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

C11H12N2O5 (252.0746)


   

9-Oxo-10-acridineacetic acid

Acridone N-methyl-N-(alpha,D-glucopyranosyl)ammonium 10-methylenecarboxylate

C15H12N2O2 (252.0899)


D007155 - Immunologic Factors > D007369 - Interferon Inducers

   

Amdoxovir

[4-(2,6-diamino-9H-purin-9-yl)-1,3-dioxolan-2-yl]methanol

C9H12N6O3 (252.0971)


   

Cndac

2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolane-3-carbonitrile

C10H12N4O4 (252.0859)


   

Glucose propionate

2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl propanoic acid

C9H16O8 (252.0845)


   

S-Methyl-KE-298

4-(4-Methylphenyl)-2-[(methylsulphanyl)methyl]-4-oxobutanoic acid

C13H16O3S (252.082)


   

[(2R,3S,4R,5R)-3,4,5,6-Tetrahydroxy-1-oxohexan-2-yl] 2-hydroxypropanoate

[(2R,3S,4R,5R)-3,4,5,6-Tetrahydroxy-1-oxohexan-2-yl] 2-hydroxypropanoic acid

C9H16O8 (252.0845)


   

Thymine dimer

4a,4b-dimethyl-dodecahydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetrone

C10H12N4O4 (252.0859)


   

2-Methoxyflavone

2-Methoxyflavone

C16H12O3 (252.0786)


   

Pyrenochaetic acid B

Pyrenochaetic acid B

C13H16O5 (252.0998)


   

Leiocarpin C

Leiocarpin C

C13H16O5 (252.0998)


   

Descurainolide A

Descurainolide A

C13H16O5 (252.0998)


   

Sinapic acid ethyl ester

Sinapic acid ethyl ester

C13H16O5 (252.0998)


   

Dehydroeffusal

Dehydroeffusal

C16H12O3 (252.0786)


   

3-O-Acetylniduloic acid

3-O-Acetylniduloic acid

C13H16O5 (252.0998)


   

3-Methoxy-3-epiradicinol

(-)-3-Methoxy-3-epiradicinol

C13H16O5 (252.0998)


   

Dihydrocitrinin

Dihydrocitrinin

C13H16O5 (252.0998)


   

(+)-Garvensintriol

(+)-Garvensintriol

C13H16O5 (252.0998)


   

1-Methoxy-2-methylanthraquinone

1-Methoxy-2-methylanthraquinone

C16H12O3 (252.0786)


   

6-Methoxyflavone

6-Methoxyflavone

C16H12O3 (252.0786)


   

7-Methoxyflavone

7-Methoxyflavone

C16H12O3 (252.0786)


7-Methoxyflavone is a compound isolated from Zornia brasiliensis. 7-Methoxyflavone has peripheral antinociceptive activity. 7-Methoxyflavone inhibits paw-licking time in the neurogenic phase of the formalin pain response (65.6\%) and did not decrease the nociceptive response in the inflammatory phase[1].

   

7-Hydroxy-2-methylisoflavone

7-hydroxy-2-methyl-3-phenylchromen-4-one

C16H12O3 (252.0786)


   

Procyazine

Procyazine

C10H13ClN6 (252.089)


CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3705; ORIGINAL_PRECURSOR_SCAN_NO 3703 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3707; ORIGINAL_PRECURSOR_SCAN_NO 3705 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3700; ORIGINAL_PRECURSOR_SCAN_NO 3698 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3716; ORIGINAL_PRECURSOR_SCAN_NO 3711 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3712; ORIGINAL_PRECURSOR_SCAN_NO 3707 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7864; ORIGINAL_PRECURSOR_SCAN_NO 7862 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7870; ORIGINAL_PRECURSOR_SCAN_NO 7866 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7885; ORIGINAL_PRECURSOR_SCAN_NO 7882 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7886; ORIGINAL_PRECURSOR_SCAN_NO 7883 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7900; ORIGINAL_PRECURSOR_SCAN_NO 7898 CONFIDENCE standard compound; INTERNAL_ID 1227; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7908; ORIGINAL_PRECURSOR_SCAN_NO 7903

   

4-Methoxyflavone

4-Methoxyflavone

C16H12O3 (252.0786)


   
   

6-Methylflavonol

6-Methylflavonol

C16H12O3 (252.0786)


relative retention time with respect to 9-anthracene Carboxylic Acid is 1.301 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.299

   

7-Hydroxy-3-methylflavone

4H-1-Benzopyran-4-one,7-hydroxy-3-methyl-2-phenyl-

C16H12O3 (252.0786)


relative retention time with respect to 9-anthracene Carboxylic Acid is 1.155 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.156

   

2-Methyl-5-methoxy-7-hydroxy-8-(2-hydroxyethyl)-2,3-dihydro-4H-1-benzopyran-4-one

2-Methyl-5-methoxy-7-hydroxy-8-(2-hydroxyethyl)-2,3-dihydro-4H-1-benzopyran-4-one

C13H16O5 (252.0998)


   

2-benzylidene-6-methoxy-1-benzofuran-3-one

2-benzylidene-6-methoxy-1-benzofuran-3-one

C16H12O3 (252.0786)


   

5-Methoxyflavone

5-Methoxyflavone

C16H12O3 (252.0786)


   
   

plumeridin B

plumeridin B

C13H16O5 (252.0998)


   

4-O-((1S)-1-carboxyethyl)-D-mannose|4-O-(1-Carboxyethyl)mannose|4-O-(1-carboxyethyl)-D-mannose|4-O-(1-carboxyethyl)mannose|4-O-<1-carboxyethyl>mannose

4-O-((1S)-1-carboxyethyl)-D-mannose|4-O-(1-Carboxyethyl)mannose|4-O-(1-carboxyethyl)-D-mannose|4-O-(1-carboxyethyl)mannose|4-O-<1-carboxyethyl>mannose

C9H16O8 (252.0845)


   

9-(Hydroxymethyl)-10-vinyl-3H-naphtho[2,1-b]pyran-3-one

9-(Hydroxymethyl)-10-vinyl-3H-naphtho[2,1-b]pyran-3-one

C16H12O3 (252.0786)


   

2-Methoxy-3-methylanthracene-9,10-dione

2-Methoxy-3-methylanthracene-9,10-dione

C16H12O3 (252.0786)


   

SCHEMBL10993604

SCHEMBL10993604

C15H12N2O2 (252.0899)


   

106897-08-9

106897-08-9

C13H16O5 (252.0998)


   
   

Nordracorhodin

Nordracorhodin

C16H12O3 (252.0786)


   

3-(4-Hydroxy-3,5-dimethoxy-phenyl)-acrylic acid ethyl ester

3-(4-Hydroxy-3,5-dimethoxy-phenyl)-acrylic acid ethyl ester

C13H16O5 (252.0998)


   

(+)-calopin|calopin

(+)-calopin|calopin

C13H16O5 (252.0998)


   

(S)-3-ethyl-5,6,7- trimethoxyphfhalide

(S)-3-ethyl-5,6,7- trimethoxyphfhalide

C13H16O5 (252.0998)


   

O=Cc1c2c3c(c(C)c(O)cc3)ccc2cc(O)c1

O=Cc1c2c3c(c(C)c(O)cc3)ccc2cc(O)c1

C16H12O3 (252.0786)


   

2-(1,2-dihydroxyisopropyl)-5,6-dimethoxybenzofuran|2-(5,6-dimethoxy-benzofuran-2-yl)-propane-1,2-diol

2-(1,2-dihydroxyisopropyl)-5,6-dimethoxybenzofuran|2-(5,6-dimethoxy-benzofuran-2-yl)-propane-1,2-diol

C13H16O5 (252.0998)


   

1-Ethoxy-3,4-dihydro-8-hydroxy-6-methoxy-1H-2-benzopyran-7-carboxaldehyde|emehetin

1-Ethoxy-3,4-dihydro-8-hydroxy-6-methoxy-1H-2-benzopyran-7-carboxaldehyde|emehetin

C13H16O5 (252.0998)


   

4,8-dihydroxy-7-(2-hydroxy-ethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

4,8-dihydroxy-7-(2-hydroxy-ethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

C13H16O5 (252.0998)


   

1-methoxy-2-methylanthracene-9,10-dione

1-methoxy-2-methylanthracene-9,10-dione

C16H12O3 (252.0786)


   

4,5-dihydro-9-methoxycanthin-6-one|9-methoxycanthin-6-one

4,5-dihydro-9-methoxycanthin-6-one|9-methoxycanthin-6-one

C15H12N2O2 (252.0899)


   

[4-(1-acetyloxyethyl)-2-methoxyphenyl] acetate

[4-(1-acetyloxyethyl)-2-methoxyphenyl] acetate

C13H16O5 (252.0998)


   

Danshenxinkun C

Danshenxinkun C

C16H12O3 (252.0786)


   

2,6-dihydroxy-3-isobutyryl-4-methoxy-5-methylbenzaldehyde

2,6-dihydroxy-3-isobutyryl-4-methoxy-5-methylbenzaldehyde

C13H16O5 (252.0998)


   

(2-glyceryl)-O-coniferaldehyde

(2-glyceryl)-O-coniferaldehyde

C13H16O5 (252.0998)


   

Methyl 2,4,5-trimethoxycinnamate

Methyl 2,4,5-trimethoxycinnamate

C13H16O5 (252.0998)


   

cis-2,2-dimethyl-3,4,7-trihydroxy-6-acetylchroman

cis-2,2-dimethyl-3,4,7-trihydroxy-6-acetylchroman

C13H16O5 (252.0998)


   

2,3-bis(hydroxymethyl)-7-hydroxy-6-methoxy-1-tetralone

2,3-bis(hydroxymethyl)-7-hydroxy-6-methoxy-1-tetralone

C13H16O5 (252.0998)


A member of the class of tetralins that is 3,4-dihydronaphthalen-1(2H)-one substituted by a hydroxy group at position 7, two hydroxymethyl groups at positions 2 and 4 and a methoxy group at position 6. It has been isolated from Taxus yunnanensis. D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065692 - Cytochrome P-450 CYP3A Inhibitors

   

8-Hydroxy-9-methyl-10-vinyl-3H-naphtho[2,1-b]pyran-3-one

8-Hydroxy-9-methyl-10-vinyl-3H-naphtho[2,1-b]pyran-3-one

C16H12O3 (252.0786)


   

5-Methoxycanthin-6-one

5-Methoxycanthin-6-one

C15H12N2O2 (252.0899)


   

2,3-Dihydro-12,13-dihydroxyeuparin

1-[2-(1,2-dihydroxypropan-2-yl)-6-hydroxy-2,3-dihydro-1-benzofuran-5-yl]ethan-1-one

C13H16O5 (252.0998)


   

(+)-(7S,8R,8R)-4,8-dihydroxy-3-methoxy-1,2,3,4,5,6-hexanorligna-7,7-lactone

(+)-(7S,8R,8R)-4,8-dihydroxy-3-methoxy-1,2,3,4,5,6-hexanorligna-7,7-lactone

C13H16O5 (252.0998)


   

methyl 7-hydroxyanodendroate

methyl 7-hydroxyanodendroate

C13H16O5 (252.0998)


   

3-ethoxy-4-hydroxymethyl-7-methoxy-6-methyl-3H-isobenzofuran-1-one|dihydrogladiolic acid ethyl lactal

3-ethoxy-4-hydroxymethyl-7-methoxy-6-methyl-3H-isobenzofuran-1-one|dihydrogladiolic acid ethyl lactal

C13H16O5 (252.0998)


   

cowaphloroglucinol

cowaphloroglucinol

C13H16O5 (252.0998)


   

7-Methyl-8-hydroxy-10-vinyl-3H-naphtho[2,1-b]pyran-3-one

7-Methyl-8-hydroxy-10-vinyl-3H-naphtho[2,1-b]pyran-3-one

C16H12O3 (252.0786)


   

1-hydroxy-2,7-dimethylanthraquinone

1-hydroxy-2,7-dimethylanthraquinone

C16H12O3 (252.0786)


   

5-hydroxy-6-(2-hydroxyethyl)-7-methoxy-2-methylchroman-4-one

5-hydroxy-6-(2-hydroxyethyl)-7-methoxy-2-methylchroman-4-one

C13H16O5 (252.0998)


   

4-(Acetyloxy)-3-methoxybenzenethanol Acetate

4-(Acetyloxy)-3-methoxybenzenethanol Acetate

C13H16O5 (252.0998)


   

SCHEMBL10607777

SCHEMBL10607777

C13H16O5 (252.0998)


   

(3R)-7-hydroxy-3-((S)-1-hydroxyethyl)-5-methoxy-3,4-dimethylisobenzofuran-1(3H)-one|(R)-7-hydroxy-3-((S)-1-hydroxyethyl)-5-methoxy-3,4-dimethylisobenzofuran-1(3H)-one

(3R)-7-hydroxy-3-((S)-1-hydroxyethyl)-5-methoxy-3,4-dimethylisobenzofuran-1(3H)-one|(R)-7-hydroxy-3-((S)-1-hydroxyethyl)-5-methoxy-3,4-dimethylisobenzofuran-1(3H)-one

C13H16O5 (252.0998)


   

(3S*,4S*)-7-ethyl-3,4-dihydro-3,4,8-trihydroxy-6-methoxynaphthalen-1(2H)-one|(3S,4S)-7-ethyl-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone|botryosphaerone D

(3S*,4S*)-7-ethyl-3,4-dihydro-3,4,8-trihydroxy-6-methoxynaphthalen-1(2H)-one|(3S,4S)-7-ethyl-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone|botryosphaerone D

C13H16O5 (252.0998)


   

2,4-dihydroxy-6-(4-hydroxy-2-oxopentyl)-3-methylbenzaldehyde

2,4-dihydroxy-6-(4-hydroxy-2-oxopentyl)-3-methylbenzaldehyde

C13H16O5 (252.0998)


   

speciosin M

speciosin M

C13H16O5 (252.0998)


   

acremostrictin

acremostrictin

C13H16O5 (252.0998)


   

methyl 2-(2-acetyl-3,5-dihydroxy-4,6-dimethylphenyl)acetate

methyl 2-(2-acetyl-3,5-dihydroxy-4,6-dimethylphenyl)acetate

C13H16O5 (252.0998)


   

jiadifenone

jiadifenone

C13H16O5 (252.0998)


   

6-(2,4-dihydroxy-5-methylphenyl)-6-oxohexanoic acid

6-(2,4-dihydroxy-5-methylphenyl)-6-oxohexanoic acid

C13H16O5 (252.0998)


   

Sclerotinin A

Sclerotinin A

C13H16O5 (252.0998)


   

3-((Xi)-Benzyliden)-6-methoxy-3H-benzofuran-2-on|3-Benzyliden-6-methoxy-cumaran-2-on|3-Benzylidene-6-methoxy-2(3H)-benzofuranone|3-benzylidene-6-methoxy-3H-benzofuran-2-one|6-methoxy-isoaurone|6-methoxyisoaurone

3-((Xi)-Benzyliden)-6-methoxy-3H-benzofuran-2-on|3-Benzyliden-6-methoxy-cumaran-2-on|3-Benzylidene-6-methoxy-2(3H)-benzofuranone|3-benzylidene-6-methoxy-3H-benzofuran-2-one|6-methoxy-isoaurone|6-methoxyisoaurone

C16H12O3 (252.0786)


   

pyrenochaetic acid D

pyrenochaetic acid D

C13H16O5 (252.0998)


   

Microsphaerophthalide A

Microsphaerophthalide A

C13H16O5 (252.0998)


   

10-methoxycanthin-6-one|4,5-dihydro-10-methoxycanthin-6-one|4,5-Dihydromethylaervine

10-methoxycanthin-6-one|4,5-dihydro-10-methoxycanthin-6-one|4,5-Dihydromethylaervine

C15H12N2O2 (252.0899)


   
   

9,10-Anthracenedione, 1-hydroxydimethyl-

9,10-Anthracenedione, 1-hydroxydimethyl-

C16H12O3 (252.0786)


   

2,5-Dihydroxy-2-isopropyl-7-methoxychroman-4-one

2,5-Dihydroxy-2-isopropyl-7-methoxychroman-4-one

C13H16O5 (252.0998)


   

2,4-dihydroxy-3(2,3-epoxy-3-methylbutyl)-6-methoxybenzaldehyde

2,4-dihydroxy-3(2,3-epoxy-3-methylbutyl)-6-methoxybenzaldehyde

C13H16O5 (252.0998)


   

2-(4-hydroxybenzyl)quinazolin-4(3H)-one

2-(4-hydroxybenzyl)quinazolin-4(3H)-one

C15H12N2O2 (252.0899)


A quinazoline alkaloid that is quinazolin-4(3H)-one substituted by a 4-hydroxybenzyl group at position 2. It has been isolated from Penicillium paneum and Isaria farinosa.

   

5-hydroxymethylcanthin-6-one

5-hydroxymethylcanthin-6-one

C15H12N2O2 (252.0899)


   

SCHEMBL3932356

SCHEMBL3932356

C13H16O5 (252.0998)


   

6-(2-chloroethyl)-2(S)-hydroxymethyl-5,7-dimethylindan-1-one

6-(2-chloroethyl)-2(S)-hydroxymethyl-5,7-dimethylindan-1-one

C14H17ClO2 (252.0917)


   

nothoapiole

nothoapiole

C13H16O5 (252.0998)


   

8-carboxyl-3-hydroxy-5-methoxy-2-dimethyl chroman|8-carboxyl-3-hydroxy-5-methoxy-2-dimethylchroman

8-carboxyl-3-hydroxy-5-methoxy-2-dimethyl chroman|8-carboxyl-3-hydroxy-5-methoxy-2-dimethylchroman

C13H16O5 (252.0998)


   

4-Hydroxy-2-(2,4,5-trimethoxyphenyl)-2E-butenal

4-Hydroxy-2-(2,4,5-trimethoxyphenyl)-2E-butenal

C13H16O5 (252.0998)


   

1-hydroxy-3-ethyl-9,10-anthraquinone|3-Aethyl-1-hydroxy-anthrachinon|3-ethyl-1-hydroxy-anthraquinone|cordifoliol

1-hydroxy-3-ethyl-9,10-anthraquinone|3-Aethyl-1-hydroxy-anthrachinon|3-ethyl-1-hydroxy-anthraquinone|cordifoliol

C16H12O3 (252.0786)


   

2,3-O-Benzylidene-beta-D-Pyranose-1,6-Anhydromannose

2,3-O-Benzylidene-beta-D-Pyranose-1,6-Anhydromannose

C13H16O5 (252.0998)


   

Arthropsolide D

Arthropsolide D

C13H16O5 (252.0998)


   

(+)-<2,4-dihydroxy-3(2-(R)-hydroxy-3-methyl-3-butenyl)>-6-methoxybenzaldehyde|(+)-[2,4-dihydroxy-3(2-(R)-hydroxy-3-methyl-3-butenyl)]-6-methoxybenzaldehyde

(+)-<2,4-dihydroxy-3(2-(R)-hydroxy-3-methyl-3-butenyl)>-6-methoxybenzaldehyde|(+)-[2,4-dihydroxy-3(2-(R)-hydroxy-3-methyl-3-butenyl)]-6-methoxybenzaldehyde

C13H16O5 (252.0998)


   

CHEMBL498337

CHEMBL498337

C13H16O5 (252.0998)


   

2-benzoyloxycinnamaldehyde

2-benzoyloxycinnamaldehyde

C16H12O3 (252.0786)


   

CHEMBL1215503

CHEMBL1215503

C16H12O3 (252.0786)


   

2-Methyl-4-methoxyanthrachinon

2-Methyl-4-methoxyanthrachinon

C16H12O3 (252.0786)


   

2-(4-Hydroxyphenyl)-3-methylbenzofuran-5-carbaldehyde

2-(4-Hydroxyphenyl)-3-methylbenzofuran-5-carbaldehyde

C16H12O3 (252.0786)


   

A1-00200

InChI=1/C16H12O3/c1-18-12-7-8-13-14(17)10-15(19-16(13)9-12)11-5-3-2-4-6-11/h2-10H,1H

C16H12O3 (252.0786)


7-Methoxyflavone is a member of flavonoids and an ether. 7-Methoxyflavone is a natural product found in Ziziphus mauritiana, Conchocarpus heterophyllus, and other organisms with data available. 7-Methoxyflavone is a compound isolated from Zornia brasiliensis. 7-Methoxyflavone has peripheral antinociceptive activity. 7-Methoxyflavone inhibits paw-licking time in the neurogenic phase of the formalin pain response (65.6\%) and did not decrease the nociceptive response in the inflammatory phase[1].

   

Oprea1_109952

InChI=1/C16H12O3/c1-18-16-14(17)12-9-5-6-10-13(12)19-15(16)11-7-3-2-4-8-11/h2-10H,1H

C16H12O3 (252.0786)


3-Methoxyflavone is a flavonoid compound isolated from Artemisia incanescens with antiviral activity[1][2].

   

Trinexapac-ethyl

Trinexapac-ethyl

C13H16O5 (252.0998)


CONFIDENCE standard compound; INTERNAL_ID 53; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4596; ORIGINAL_PRECURSOR_SCAN_NO 4593 CONFIDENCE standard compound; INTERNAL_ID 53; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4433; ORIGINAL_PRECURSOR_SCAN_NO 4431 CONFIDENCE standard compound; INTERNAL_ID 53; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4395; ORIGINAL_PRECURSOR_SCAN_NO 4390 CONFIDENCE standard compound; INTERNAL_ID 53; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4078; ORIGINAL_PRECURSOR_SCAN_NO 4076 CONFIDENCE standard compound; INTERNAL_ID 53; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4447; ORIGINAL_PRECURSOR_SCAN_NO 4445 CONFIDENCE standard compound; INTERNAL_ID 53; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4226; ORIGINAL_PRECURSOR_SCAN_NO 4224 CONFIDENCE standard compound; EAWAG_UCHEM_ID 151

   

PERYLENE

PERYLENE

C20H12 (252.0939)


Concentration of perylene solution 1 mg/ L; Injection volume 10 microL;. Post column addition of NaAuCl4 acetonitrile solution (5 mg /L) at 0.05 mL/min.

   

Nebularine

Nebularine

C10H12N4O4 (252.0859)


A purine ribonucleoside that is 9H-purine attached to a beta-D-ribofuranosyl residue at position 9 via a glycosidic (N-glycosyl) linkage. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D000970 - Antineoplastic Agents relative retention time with respect to 9-anthracene Carboxylic Acid is 0.257 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.250

   

OXCARBAZEPINE

2-Hydroxycarbamazepine

C15H12N2O2 (252.0899)


D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AF - Carboxamide derivatives D065693 - Cytochrome P-450 Enzyme Inducers > D065701 - Cytochrome P-450 CYP3A Inducers C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D049990 - Membrane Transport Modulators CONFIDENCE standard compound; INTERNAL_ID 8583

   

phenytoin

Phenytoin (Lepitoin)

C15H12N2O2 (252.0899)


D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AB - Hydantoin derivatives D065693 - Cytochrome P-450 Enzyme Inducers > D065694 - Cytochrome P-450 CYP1A2 Inducers C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker

   

3-(4-methoxy-phenyl)-isochromen-1-one

NCGC00160252-01!3-(4-methoxy-phenyl)-isochromen-1-one

C16H12O3 (252.0786)


   

METHYLHALFORDINOL

NCGC00160219-01!METHYLHALFORDINOL

C15H12N2O2 (252.0899)


   

methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

NCGC00385894-01!methyl (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

C13H16O5 (252.0998)


   

2-(2-methoxyphenyl)chromen-4-one

NCGC00168873-02!2-(2-methoxyphenyl)chromen-4-one

C16H12O3 (252.0786)


   

2-(4-methoxyphenyl)chromen-4-one

NCGC00095556-05!2-(4-methoxyphenyl)chromen-4-one

C16H12O3 (252.0786)


   

5-methoxy-2-phenylchromen-4-one

NCGC00142613-04!5-methoxy-2-phenylchromen-4-one

C16H12O3 (252.0786)


   

6-methoxy-2-phenylchromen-4-one

NCGC00177162-03!6-methoxy-2-phenylchromen-4-one

C16H12O3 (252.0786)


   

(2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one

NCGC00180534-02!(2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one

C13H16O5 (252.0998)


   

C13H16O5_8-Methyl-3,4,6,10b-tetrahydropyrano[3,2-c]isochromene-4a,7,9(2H)-triol

NCGC00380856-01_C13H16O5_8-Methyl-3,4,6,10b-tetrahydropyrano[3,2-c]isochromene-4a,7,9(2H)-triol

C13H16O5 (252.0998)


   

Deoxyinosine

2-Deoxyinosine

C10H12N4O4 (252.0859)


2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency. 2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency.

   
   

(2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one

(2R)-7-hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydrochromen-4-one

C13H16O5 (252.0998)


   

Methyl 3,4,5-trimethoxycinnamate

methyl (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

C13H16O5 (252.0998)


   

(2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one

(2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one

C16H12O3 (252.0786)


   

Carbamazepine-10,11-epoxide

Carbamazepine-10,11-epoxide

C15H12N2O2 (252.0899)


An epoxide and metabolite of carbamazepine. CONFIDENCE standard compound; INTERNAL_ID 2038

   

Carbamazepine 10,11-epoxide

Carbamazepine-10,11-epoxide

C15H12N2O2 (252.0899)


   

2-(4-methoxyphenyl)chromen-4-one [IIN-based on: CCMSLIB00000847204]

NCGC00095556-05!2-(4-methoxyphenyl)chromen-4-one [IIN-based on: CCMSLIB00000847204]

C16H12O3 (252.0786)


   

5-methoxy-2-phenylchromen-4-one [IIN-based on: CCMSLIB00000847375]

NCGC00142613-04!5-methoxy-2-phenylchromen-4-one [IIN-based on: CCMSLIB00000847375]

C16H12O3 (252.0786)


   

5-methoxy-2-phenylchromen-4-one [IIN-based: Match]

NCGC00142613-04!5-methoxy-2-phenylchromen-4-one [IIN-based: Match]

C16H12O3 (252.0786)


   

2-(4-methoxyphenyl)chromen-4-one [IIN-based: Match]

NCGC00095556-05!2-(4-methoxyphenyl)chromen-4-one [IIN-based: Match]

C16H12O3 (252.0786)


   

2-carboxylic acid derivative of Oxamniquine

2-carboxylic acid derivative of Oxamniquine

C11H12N2O5 (252.0746)


   

Anisindione

Anisindione

C16H12O3 (252.0786)


C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent

   

Eugenone

1-(2,4,6-trimethoxyphenyl)butane-1,3-dione

C13H16O5 (252.0998)


   

gamma-L-Glutaminyl-3,4-benzoquinone

2-amino-4-[(3,4-dioxocyclohexa-1,5-dien-1-yl)carbamoyl]butanoic acid

C11H12N2O5 (252.0746)


   

Pterosin J

6-(2-Chloroethyl)-2,3-dihydro-3-hydroxy-2,5,7-trimethyl-1H-inden-1-one

C14H17ClO2 (252.0917)


   

Methylhalfordinol

3-[5-(4-Methoxyphenyl)-2-oxazolyl]pyridine, 9ci

C15H12N2O2 (252.0899)


   

Antibiotic LL-D253alpha

(2R)-7-Hydroxy-8-(2-hydroxyethyl)-5-methoxy-2-methyl-2,3-dihydro-4H-chromen-4-one

C13H16O5 (252.0998)


   

7-HYDROXY-3-METHYL-4-PHENYLCOUMARIN

7-HYDROXY-3-METHYL-4-PHENYLCOUMARIN

C16H12O3 (252.0786)


   

2-Butanone,2-(2,4-dinitrophenyl)hydrazone

2-Butanone,2-(2,4-dinitrophenyl)hydrazone

C10H12N4O4 (252.0859)


   

5-(Benzyloxy)-1H-indazole-3-carbaldehyde

5-(Benzyloxy)-1H-indazole-3-carbaldehyde

C15H12N2O2 (252.0899)


   

1-amino-4-(methylamino)anthraquinone

1-amino-4-(methylamino)anthraquinone

C15H12N2O2 (252.0899)


   

2-(4-hydroxyphenyl)-3-methylchromen-4-one

2-(4-hydroxyphenyl)-3-methylchromen-4-one

C16H12O3 (252.0786)


   

3-benzyloxybenzotrifluoride

3-benzyloxybenzotrifluoride

C14H11F3O (252.0762)


   

3-(PROPYLCARBAMOYL)-5-NITROPHENYLBORONIC ACID

3-(PROPYLCARBAMOYL)-5-NITROPHENYLBORONIC ACID

C10H13BN2O5 (252.0917)


   

(4-FLUOROBENZYL)(PYRIDIN-4-YLMETHYL)AMINE

(4-FLUOROBENZYL)(PYRIDIN-4-YLMETHYL)AMINE

C13H14ClFN2 (252.0829)


   

2-Thiazolamine,4,5-diphenyl-

2-Thiazolamine,4,5-diphenyl-

C15H12N2S (252.0721)


   

4-(2-AMINO-THIAZOL-4-YL)-1-OXA-SPIRO[4.5]DECAN-2-ONE

4-(2-AMINO-THIAZOL-4-YL)-1-OXA-SPIRO[4.5]DECAN-2-ONE

C12H16N2O2S (252.0932)


   

7-Hydroxy-8-methyl-4-phenyl-2H-chromen-2-one

7-Hydroxy-8-methyl-4-phenyl-2H-chromen-2-one

C16H12O3 (252.0786)


   

2-PYRIDIN-2-YLMETHYL-4H-ISOQUINOLINE-1,3-DIONE

2-PYRIDIN-2-YLMETHYL-4H-ISOQUINOLINE-1,3-DIONE

C15H12N2O2 (252.0899)


   

4-(Carboxy-hydroxy-methyl)-benzoic acid tert-butyl ester

4-(Carboxy-hydroxy-methyl)-benzoic acid tert-butyl ester

C13H16O5 (252.0998)


   

(4-Trifluoromethylbiphenyl-4-yl)methanol

(4-Trifluoromethylbiphenyl-4-yl)methanol

C14H11F3O (252.0762)


   

1-oxo-2,3-dihydro-1h-inden-4-yl benzoate

1-oxo-2,3-dihydro-1h-inden-4-yl benzoate

C16H12O3 (252.0786)


   

2-(2-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole

2-(2-methoxyphenyl)-5-phenyl-1,3,4-oxadiazole

C15H12N2O2 (252.0899)


   

1,2-Diphenyl-pyrazolidine-3,5-dione

1,2-Diphenyl-pyrazolidine-3,5-dione

C15H12N2O2 (252.0899)


   

3-PHENYL-IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER

3-PHENYL-IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID METHYL ESTER

C15H12N2O2 (252.0899)


   
   

N-(4-CYANO-PHENYL)-2-(4-HYDROXY-PHENYL)-ACETAMIDE

N-(4-CYANO-PHENYL)-2-(4-HYDROXY-PHENYL)-ACETAMIDE

C15H12N2O2 (252.0899)


   

N-(3-CYANO-PHENYL)-2-(4-HYDROXY-PHENYL)-ACETAMIDE

N-(3-CYANO-PHENYL)-2-(4-HYDROXY-PHENYL)-ACETAMIDE

C15H12N2O2 (252.0899)


   

5-(4-ETHYLTHIOPHENYL)-5-OXOVALERIC ACID

5-(4-ETHYLTHIOPHENYL)-5-OXOVALERIC ACID

C13H16O3S (252.082)


   

Ethyl 4-(carboxymethyl)-2-ethoxybenzoate

Ethyl 4-(carboxymethyl)-2-ethoxybenzoate

C13H16O5 (252.0998)


   

4-biphenyl-4-yl-thiazol-2-ylamine

4-biphenyl-4-yl-thiazol-2-ylamine

C15H12N2S (252.0721)


   

ethyl 4-acetamido-3-nitrobenzoate

ethyl 4-acetamido-3-nitrobenzoate

C11H12N2O5 (252.0746)


   

3-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)PROPANOIC ACID

3-(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-7H-PURIN-7-YL)PROPANOIC ACID

C10H12N4O4 (252.0859)


   

1,1,1,2,2,3,3-heptafluoronon-4-ene

1,1,1,2,2,3,3-heptafluoronon-4-ene

C9H11F7 (252.0749)


   

Glycine,N-(4-nitrobenzoyl)-, ethyl ester

Glycine,N-(4-nitrobenzoyl)-, ethyl ester

C11H12N2O5 (252.0746)


   

1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carbonitrile

1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carbonitrile

C14H9FN4 (252.0811)


   

4-METHYL-N-(1-METHYLPYRROLIDIN-2-YLIDENE)BENZENESULFONAMIDE

4-METHYL-N-(1-METHYLPYRROLIDIN-2-YLIDENE)BENZENESULFONAMIDE

C12H16N2O2S (252.0932)


   

2,5-diphenylthiazol-4-amine

2,5-diphenylthiazol-4-amine

C15H12N2S (252.0721)


   

4`-Formylbenzo-12-crown-4

4`-Formylbenzo-12-crown-4

C13H16O5 (252.0998)


   

12-DIMYRISTOYL-RAC-GLYCEROL(C14:0)

12-DIMYRISTOYL-RAC-GLYCEROL(C14:0)

C15H12N2O2 (252.0899)


   

2-(2-Phenylimidazo[1,2-a]pyridin-3-yl)acetic acid

2-(2-Phenylimidazo[1,2-a]pyridin-3-yl)acetic acid

C15H12N2O2 (252.0899)


   

Benzenesulfonic acid,4-methyl-, 2-cyclopentylidenehydrazide

Benzenesulfonic acid,4-methyl-, 2-cyclopentylidenehydrazide

C12H16N2O2S (252.0932)


   

DIMETHYL(N,N,N,N-TETRAMETHYLETHYLENEDIAMINE)PALLADIUM(II)

DIMETHYL(N,N,N,N-TETRAMETHYLETHYLENEDIAMINE)PALLADIUM(II)

C8H22N2Pd (252.0818)


   

2-(4-(dimethylamino)phenyl)-1,3-thiazolidine-4-carboxylic acid

2-(4-(dimethylamino)phenyl)-1,3-thiazolidine-4-carboxylic acid

C12H16N2O2S (252.0932)


   

Benzenemethanol, a-phenyl-a-(trifluoromethyl)-

Benzenemethanol, a-phenyl-a-(trifluoromethyl)-

C14H11F3O (252.0762)


   

(3-(Isopropylcarbamoyl)-5-nitrophenyl)boronic acid

(3-(Isopropylcarbamoyl)-5-nitrophenyl)boronic acid

C10H13BN2O5 (252.0917)


   

4-Hydroxy-6-methylflavone

4-Hydroxy-6-methylflavone

C16H12O3 (252.0786)


   

2-benzyl-3H-benzimidazole-5-carboxylic acid

2-benzyl-3H-benzimidazole-5-carboxylic acid

C15H12N2O2 (252.0899)


   

3-(2-PHENYL-THIAZOL-4-YL)-PHENYLAMINE

3-(2-PHENYL-THIAZOL-4-YL)-PHENYLAMINE

C15H12N2S (252.0721)


   

3-ethyl-5-[2-(1-methylpyrrolidin-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one

3-ethyl-5-[2-(1-methylpyrrolidin-2-ylidene)ethylidene]-2-sulfanylidene-1,3-oxazolidin-4-one

C12H16N2O2S (252.0932)


   

2H-1-Benzopyran-3-carboxylic acid, 2-phenyl

2H-1-Benzopyran-3-carboxylic acid, 2-phenyl

C16H12O3 (252.0786)


   

7-(4-Fluoro-phenyl)-4,7-dioxo-heptanoic acid

7-(4-Fluoro-phenyl)-4,7-dioxo-heptanoic acid

C13H13FO4 (252.0798)


   

1,3-diethynylbenzene,1,4-diethynylbenzene

1,3-diethynylbenzene,1,4-diethynylbenzene

C20H12 (252.0939)


   

2,7-DIMETHYL-9-FLUORENONE-4-CARBOXYLIC ACID

2,7-DIMETHYL-9-FLUORENONE-4-CARBOXYLIC ACID

C16H12O3 (252.0786)


   

(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZENE

(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZENE

C12H16N2O2S (252.0932)


   

N1-Phenyl-4-(trifluoromethyl)benzene-1,2-diamine

N1-Phenyl-4-(trifluoromethyl)benzene-1,2-diamine

C13H11F3N2 (252.0874)


   

3-(2-aminoethyl)-6-fluoro-5-methoxy-1H-indole-2-carboxylic acid

3-(2-aminoethyl)-6-fluoro-5-methoxy-1H-indole-2-carboxylic acid

C12H13FN2O3 (252.091)


   

7-phenylmethoxy-1H-quinazolin-4-one

7-phenylmethoxy-1H-quinazolin-4-one

C15H12N2O2 (252.0899)


   

3-Trifluoromethylbenzhydrol

3-Trifluoromethylbenzhydrol

C14H11F3O (252.0762)


   

4-Benzoylphenyl acrylate

4-Benzoylphenyl acrylate

C16H12O3 (252.0786)


   

5-morpholino-2-nitrobenzenecarboxylic acid

5-morpholino-2-nitrobenzenecarboxylic acid

C11H12N2O5 (252.0746)


   

5-METHYL-7-HYDROXYISOFLAVONE

5-METHYL-7-HYDROXYISOFLAVONE

C16H12O3 (252.0786)


   

2-MORPHOLINO-5-NITROBENZOIC ACID

2-MORPHOLINO-5-NITROBENZOIC ACID

C11H12N2O5 (252.0746)


   

1,4-diphenylpyrazolidine-3,5-dione

1,4-diphenylpyrazolidine-3,5-dione

C15H12N2O2 (252.0899)


   

4-(benzimidazol-1-ylmethyl)benzoic acid

4-(benzimidazol-1-ylmethyl)benzoic acid

C15H12N2O2 (252.0899)


   

5-Ethynyl-2-deoxyuridine

5-Ethynyl-2-deoxyuridine

C11H12N2O5 (252.0746)


   

(4-TRIFLUOROMETHYLBIPHENYL-3-YL)METHANOL

(4-TRIFLUOROMETHYLBIPHENYL-3-YL)METHANOL

C14H11F3O (252.0762)


   

methyl 3-(1H-benzimidazol-2-yl)benzoate

methyl 3-(1H-benzimidazol-2-yl)benzoate

C15H12N2O2 (252.0899)


   

Ethyl 3-(3,4-dimethoxyphenyl)-3-oxopropanoate

Ethyl 3-(3,4-dimethoxyphenyl)-3-oxopropanoate

C13H16O5 (252.0998)


   

Benzofuran-2-carboxylic acid (4-amino-phenyl)-amide

Benzofuran-2-carboxylic acid (4-amino-phenyl)-amide

C15H12N2O2 (252.0899)


   

N-Benzoyl-L-methionine amide

N-Benzoyl-L-methionine amide

C12H16N2O2S (252.0932)


   

4-(Diacetoxymethyl)phenylboronic acid

4-(Diacetoxymethyl)phenylboronic acid

C11H13BO6 (252.0805)


   

(-)-Benzotetramisole

(-)-Benzotetramisole

C15H12N2S (252.0721)


   

N-[[[1-Methyl-1-(hydroxymethyl)ethyl]amino]thiocarbonyl]benzamide

N-[[[1-Methyl-1-(hydroxymethyl)ethyl]amino]thiocarbonyl]benzamide

C12H16N2O2S (252.0932)


   

Tert-butyl 4-fluoro-6-hydroxy-1H-indazole-1-carboxylate

Tert-butyl 4-fluoro-6-hydroxy-1H-indazole-1-carboxylate

C12H13FN2O3 (252.091)


   

2-Acetylthiophene-3-boronic acid pinacol ester

2-Acetylthiophene-3-boronic acid pinacol ester

C12H17BO3S (252.0991)


   

benzyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate

benzyl 1H-pyrrolo[2,3-b]pyridine-5-carboxylate

C15H12N2O2 (252.0899)


   

naproxen sodium

naproxen sodium

C14H13NaO3 (252.0762)


D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D018501 - Antirheumatic Agents > D006074 - Gout Suppressants C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors

   

8-BENZYLOXY-IMIDAZO[1,2-A]PYRIDINE-2-CARBALDEHYDE

8-BENZYLOXY-IMIDAZO[1,2-A]PYRIDINE-2-CARBALDEHYDE

C15H12N2O2 (252.0899)


   

3-(3,5-Dimethoxy-phenyl)-3-oxo-propionic acid ethyl ester

3-(3,5-Dimethoxy-phenyl)-3-oxo-propionic acid ethyl ester

C13H16O5 (252.0998)


   
   

1H-Isoindole-1,3(2H)-dione,2-[2-(2-pyridinyl)ethyl]-

1H-Isoindole-1,3(2H)-dione,2-[2-(2-pyridinyl)ethyl]-

C15H12N2O2 (252.0899)


   

2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(PHENYLMETHYL)-

2H-1-BENZOPYRAN-2-ONE, 4-HYDROXY-3-(PHENYLMETHYL)-

C16H12O3 (252.0786)


   

1-(4-methoxy-2,5-dimethylbenzyl)hydrazine dihydrochloride

1-(4-methoxy-2,5-dimethylbenzyl)hydrazine dihydrochloride

C10H18Cl2N2O (252.0796)


   

methyl 2-(2-acetyl-3,5-dimethoxyphenyl)acetate

methyl 2-(2-acetyl-3,5-dimethoxyphenyl)acetate

C13H16O5 (252.0998)


   

1-BENZYL-4-HYDROXY-1,8-NAPHTHYRIDIN-2(1H)-ONE

1-BENZYL-4-HYDROXY-1,8-NAPHTHYRIDIN-2(1H)-ONE

C15H12N2O2 (252.0899)


   

DIMETHYL 2-(4-METHOXYPHENYL)SUCCINATE

DIMETHYL 2-(4-METHOXYPHENYL)SUCCINATE

C13H16O5 (252.0998)


   

4-(Benzyloxy)-1H-indazole-3-carbaldehyde

4-(Benzyloxy)-1H-indazole-3-carbaldehyde

C15H12N2O2 (252.0899)


   

bis(Trimethylsilyl) Vinylphosphonate

bis(Trimethylsilyl) Vinylphosphonate

C8H21O3PSi2 (252.0767)


   

2-(3-methoxyphenyl)-4-pyridin-2-yl-1,3-oxazole

2-(3-methoxyphenyl)-4-pyridin-2-yl-1,3-oxazole

C15H12N2O2 (252.0899)


   

dimethyl 2-[(4-methoxyphenyl)methyl]propanedioate

dimethyl 2-[(4-methoxyphenyl)methyl]propanedioate

C13H16O5 (252.0998)


   

5-(3-CYANOPHENYL)-PYRIDINE-3-CARBOXYLATE, ETHYL ESTER

5-(3-CYANOPHENYL)-PYRIDINE-3-CARBOXYLATE, ETHYL ESTER

C15H12N2O2 (252.0899)


   

5-NAPHTHALEN-2-YL-1H-PYRAZOLE-3-CARBOXYLIC ACID METHYL ESTER

5-NAPHTHALEN-2-YL-1H-PYRAZOLE-3-CARBOXYLIC ACID METHYL ESTER

C15H12N2O2 (252.0899)


   

4,5-diphenyl-2-imidazolethiol

4,5-diphenyl-2-imidazolethiol

C15H12N2S (252.0721)


   

4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzaldehyde

4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzaldehyde

C15H12N2O2 (252.0899)


   

2-methyl-3-(4-nitrophenyl)-1H-indole

2-methyl-3-(4-nitrophenyl)-1H-indole

C15H12N2O2 (252.0899)


   

(S)-N-[[3-(3-Fluorophenyl)-2-oxo-5-oxazolidinyl]methyl]acetamide

(S)-N-[[3-(3-Fluorophenyl)-2-oxo-5-oxazolidinyl]methyl]acetamide

C12H13FN2O3 (252.091)


   

8-(4-Chlorophenyl)-1,4-dioxaspiro[4.5]decane

8-(4-CHLOROPHENYL)-1,4-DIOXASPRIRO[4,5]DECANE

C14H17ClO2 (252.0917)


   

4-(2-METHYL-1H-BENZO[D]IMIDAZOL-1-YL)BENZOIC ACID

4-(2-METHYL-1H-BENZO[D]IMIDAZOL-1-YL)BENZOIC ACID

C15H12N2O2 (252.0899)


   

2-acetamido-3-(4-nitrophenyl)propanoic acid

2-acetamido-3-(4-nitrophenyl)propanoic acid

C11H12N2O5 (252.0746)


   

(R)-2-Acetamido-3-(4-nitrophenyl)propanoic acid

(R)-2-Acetamido-3-(4-nitrophenyl)propanoic acid

C11H12N2O5 (252.0746)


   

1-(3-(TRIFLUOROMETHYL)BENZYL)PIPERAZINE&

1-(3-(TRIFLUOROMETHYL)BENZYL)PIPERAZINE&

C13H16O5 (252.0998)


   

(2-Phenyl-1H-benzimidazol-1-yl)acetic acid

(2-Phenyl-1H-benzimidazol-1-yl)acetic acid

C15H12N2O2 (252.0899)


   

7-hydroxy-4-methyl-3-phenylcoumarin 97

7-hydroxy-4-methyl-3-phenylcoumarin 97

C16H12O3 (252.0786)


   

2-Methyl-1-phenyl-1H-benzo[d]imidazole-5-carboxylic acid

2-Methyl-1-phenyl-1H-benzo[d]imidazole-5-carboxylic acid

C15H12N2O2 (252.0899)


   

Methyl 2-phenylimidazo[1,2-a]pyridine-6-carboxylate

Methyl 2-phenylimidazo[1,2-a]pyridine-6-carboxylate

C15H12N2O2 (252.0899)


   
   
   

7-Acetamido-8-nitro-3,4-Dihydro-2H-1,5-benzodioxepine

7-Acetamido-8-nitro-3,4-Dihydro-2H-1,5-benzodioxepine

C11H12N2O5 (252.0746)


   

3-(4-HYDROXYPHENYL)-1-PHENYL-1H-PYRAZOL-5(4H)-ONE

3-(4-HYDROXYPHENYL)-1-PHENYL-1H-PYRAZOL-5(4H)-ONE

C15H12N2O2 (252.0899)


   

9-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione

9-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-2,6-dione

C10H12N4O4 (252.0859)


   

7-Hydroxy-5-methylflavone

7-Hydroxy-5-methylflavone

C16H12O3 (252.0786)


   

dl-2,3-diphenyl-succinic acid anhydride

dl-2,3-diphenyl-succinic acid anhydride

C16H12O3 (252.0786)


   

3-(2,4-Dimethoxy-phenyl)-3-oxo-propionic acid ethyl ester

3-(2,4-Dimethoxy-phenyl)-3-oxo-propionic acid ethyl ester

C13H16O5 (252.0998)


   

diethyl 5-(hydroxymethyl)benzene-1,3-dicarboxylate

diethyl 5-(hydroxymethyl)benzene-1,3-dicarboxylate

C13H16O5 (252.0998)


   

(+)-Benzotetramisole

(+)-Benzotetramisole

C15H12N2S (252.0721)


   

4-MORPHOLINO-3-NITROBENZOIC ACID

4-MORPHOLINO-3-NITROBENZOIC ACID

C11H12N2O5 (252.0746)


   

methyl 2-phenyl-1H-pyrrolo[3,2-e]pyridine-5-carboxylate

methyl 2-phenyl-1H-pyrrolo[3,2-e]pyridine-5-carboxylate

C15H12N2O2 (252.0899)


   

N-(3-Cyanophenyl)-4-methoxybenzamide

N-(3-Cyanophenyl)-4-methoxybenzamide

C15H12N2O2 (252.0899)


   

5-Acetylthiophene-2-boronic acid pinacol ester

5-Acetylthiophene-2-boronic acid pinacol ester

C12H17BO3S (252.0991)


   

ethyl 3-(2,5-dimethoxyphenyl)-3-oxopropanoate

ethyl 3-(2,5-dimethoxyphenyl)-3-oxopropanoate

C13H16O5 (252.0998)


   

8-deuteriobenzo[a]pyrene

8-deuteriobenzo[a]pyrene

C20H12 (252.0939)


   

2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde

2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde

C15H12N2O2 (252.0899)


   

3-(2,3-DIMETHOXY-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER

3-(2,3-DIMETHOXY-PHENYL)-3-OXO-PROPIONIC ACID ETHYL ESTER

C13H16O5 (252.0998)


   

1-(4-METHOXY-PHENYL)-1H-INDAZOLE-3-CARBALDEHYDE

1-(4-METHOXY-PHENYL)-1H-INDAZOLE-3-CARBALDEHYDE

C15H12N2O2 (252.0899)


   

5-Benzyloxy-6-azaindole-3-carboxaldehyde

5-Benzyloxy-6-azaindole-3-carboxaldehyde

C15H12N2O2 (252.0899)


   

Benzenemethanol, a-phenyl-4-(trifluoromethyl)-

Benzenemethanol, a-phenyl-4-(trifluoromethyl)-

C14H11F3O (252.0762)


   

2-(benzylamino)-3-trifluoromethylpyridine

2-(benzylamino)-3-trifluoromethylpyridine

C13H11F3N2 (252.0874)


   

1-methyl-5-nitro-2-phenylindole

1-methyl-5-nitro-2-phenylindole

C15H12N2O2 (252.0899)


   

methyl 2-(2-acetyl-4,5-dimethoxyphenyl)acetate

methyl 2-(2-acetyl-4,5-dimethoxyphenyl)acetate

C13H16O5 (252.0998)


   

Butanal, (2,4-dinitrophenyl)hydrazone

Butanal, (2,4-dinitrophenyl)hydrazone

C10H12N4O4 (252.0859)


   

6-BENZYLOXY-1H-INDAZOLE-3-CARBALDEHYDE

6-BENZYLOXY-1H-INDAZOLE-3-CARBALDEHYDE

C15H12N2O2 (252.0899)


   

(2-THIEN-2-YLPHENYL)METHANOL

(2-THIEN-2-YLPHENYL)METHANOL

C14H11F3O (252.0762)


   

2-(4-Methoxyphenyl)-8-nitrosoindolizine

2-(4-Methoxyphenyl)-8-nitrosoindolizine

C15H12N2O2 (252.0899)


   

3-HYDROXY-5-PHENYL-1,3-DIHYDRO-BENZO[E][1,4]DIAZEPIN-2-ONE

3-HYDROXY-5-PHENYL-1,3-DIHYDRO-BENZO[E][1,4]DIAZEPIN-2-ONE

C15H12N2O2 (252.0899)


   

1-BENZYL-5-BROMO-1H-INDOLE

1-BENZYL-5-BROMO-1H-INDOLE

C15H12N2O2 (252.0899)


   

(5-BROMOBENZO[B]FURAN-2-YL)METHYLAMINE

(5-BROMOBENZO[B]FURAN-2-YL)METHYLAMINE

C11H13ClN4O (252.0778)


   

[4-(cyanomethyl)phenyl] N-phenylcarbamate

[4-(cyanomethyl)phenyl] N-phenylcarbamate

C15H12N2O2 (252.0899)


   

3-Hydroxy-2,8-dimethyl-1,4-phenanthrenedione

3-Hydroxy-2,8-dimethyl-1,4-phenanthrenedione

C16H12O3 (252.0786)


   

AKOS BBS-00006148

AKOS BBS-00006148

C16H12O3 (252.0786)


   

ingenol 3-benzoate

ingenol 3-benzoate

C16H12O3 (252.0786)


   

ethyl 4-(4-formyl-3-hydroxyphenoxy)butanoate

ethyl 4-(4-formyl-3-hydroxyphenoxy)butanoate

C13H16O5 (252.0998)


   

(E)-2-BenzoyloxycinnaMaldehyde

2-(3-oxoprop-1-en-1-yl)phenyl benzoate

C16H12O3 (252.0786)


   

1,1,1,2-TETRAFLUORO-2-(TRIFLUOROMETHYL)OCT-3-ENE

1,1,1,2-TETRAFLUORO-2-(TRIFLUOROMETHYL)OCT-3-ENE

C9H11F7 (252.0749)


   

AKOS BBS-00006149

AKOS BBS-00006149

C16H12O3 (252.0786)


   

3-(2-(TERT-BUTOXY)-2-OXOETHOXY)BENZOIC ACID

3-(2-(TERT-BUTOXY)-2-OXOETHOXY)BENZOIC ACID

C13H16O5 (252.0998)


   

ethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate

ethyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate

C14H17ClO2 (252.0917)


   

5-(3,4-DIMETHOXYPHENYL)-5-OXOVALERIC ACID

5-(3,4-DIMETHOXYPHENYL)-5-OXOVALERIC ACID

C13H16O5 (252.0998)


   

2,4,6-Cycloheptatrien-1-one,2-hydroxy-3-(1-oxo-3-phenyl-2-propen-1-yl)-

2,4,6-Cycloheptatrien-1-one,2-hydroxy-3-(1-oxo-3-phenyl-2-propen-1-yl)-

C16H12O3 (252.0786)


   

5-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1H-indole

5-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1H-indole

C12H16N2O2S (252.0932)


   

1-(5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-3-yl)ethanone

1-(5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-3-yl)ethanone

C12H17BO3S (252.0991)


   

diethyl 4-hydroxy-5-methyl-benzene-1,3-dicarboxylate

diethyl 4-hydroxy-5-methyl-benzene-1,3-dicarboxylate

C13H16O5 (252.0998)


   

Propanal, 2-methyl-,2-(2,4-dinitrophenyl)hydrazone

Propanal, 2-methyl-,2-(2,4-dinitrophenyl)hydrazone

C10H12N4O4 (252.0859)


   

4-Benzyloxybenzotrifluoride

4-Benzyloxybenzotrifluoride

C14H11F3O (252.0762)


   

N-(4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-2-yl)-2,2-dimethylpropionamide

N-(4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-2-yl)-2,2-dimethylpropionamide

C11H13ClN4O (252.0778)


   

1-Benzyl-1H-indazole-3-carboxylic acid

1-Benzyl-1H-indazole-3-carboxylic acid

C15H12N2O2 (252.0899)


   

ethyl o-carboethoxymethylsalicylate

ethyl o-carboethoxymethylsalicylate

C13H16O5 (252.0998)


   

4-(4-methoxyphenyl)-1-(2h)-phthalazinon&

4-(4-methoxyphenyl)-1-(2h)-phthalazinon&

C15H12N2O2 (252.0899)


   

2,3,5,6-tetrafluorothiophenol

2,3,5,6-tetrafluorothiophenol

C15H12N2O2 (252.0899)


   

4-Morpholin-4-yl-2-nitrobenzoic acid

4-Morpholin-4-yl-2-nitrobenzoic acid

C11H12N2O5 (252.0746)


   

Amdoxovir

Amdoxovir

C9H12N6O3 (252.0971)


C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97452 - Nucleoside Reverse Transcriptase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent

   

Cndac

Cndac

C10H12N4O4 (252.0859)


A pyrimidine 2-deoxyribonucleoside that is 2-deoxycytidine having a cyano group in the 2-position. It is the active metabolite of the anti-cancer drug, sapacitabine which is currently in clinical development for the treatment of hematologic malignancies and solid tumors. C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite

   
   

1,3-Dioxolane-2-methanol, 4-(2,6-diamino-9H-purin-9-yl)-

1,3-Dioxolane-2-methanol, 4-(2,6-diamino-9H-purin-9-yl)-

C9H12N6O3 (252.0971)


   

S-Methyl-KE-298

S-Methyl-KE-298

C13H16O3S (252.082)


   

2-(4-methoxyphenyl)-1H-quinazolin-4-one

2-(4-methoxyphenyl)-1H-quinazolin-4-one

C15H12N2O2 (252.0899)


   

8-Methoxyflavone

8-Methoxyflavone

C16H12O3 (252.0786)


   

Purpurester A

Purpurester A

C13H16O5 (252.0998)


A member of the class of 2-benzofurans that is 2-benzofuran-1(3H)-one substituted by hydroxy groups at positions 5 and 6, a methoxy group at position 3, a methyl group at position 7 and a propyl group at position 3. It has been isolated from Penicillium purpurogenum.

   

(5-Methoxy-3-benzofuranyl)-phenylmethanone

(5-Methoxy-3-benzofuranyl)-phenylmethanone

C16H12O3 (252.0786)


   

5-(3,4,5-Trimethoxyphenyl)-1,3,4-oxadiazol-2-ol

5-(3,4,5-Trimethoxyphenyl)-1,3,4-oxadiazol-2-ol

C11H12N2O5 (252.0746)


   

5-Amino-2-(4-methylphenyl)isoindole-1,3-dione

5-Amino-2-(4-methylphenyl)isoindole-1,3-dione

C15H12N2O2 (252.0899)


   

2-[[Cyclohexyl(oxo)methyl]amino]-3-thiophenecarboxamide

2-[[Cyclohexyl(oxo)methyl]amino]-3-thiophenecarboxamide

C12H16N2O2S (252.0932)


   

[(E)-1-(1,3-thiazol-2-yl)ethylideneamino] cyclohexanecarboxylate

[(E)-1-(1,3-thiazol-2-yl)ethylideneamino] cyclohexanecarboxylate

C12H16N2O2S (252.0932)


   

2-(p-Hydroxyphenyl)-3-benzofuranyl methyl ketone

2-(p-Hydroxyphenyl)-3-benzofuranyl methyl ketone

C16H12O3 (252.0786)


   

{4-[5-(Trifluoromethyl)pyridin-2-yl]phenyl}methylamine

{4-[5-(Trifluoromethyl)pyridin-2-yl]phenyl}methylamine

C13H11F3N2 (252.0874)


   

3-(4-Methoxyphenyl)-1h-isochromen-1-one

3-(4-Methoxyphenyl)-1h-isochromen-1-one

C16H12O3 (252.0786)


   

Trimethylsilyl acetylsalicylate

Trimethylsilyl acetylsalicylate

C12H16O4Si (252.0818)


   

4H-Naphtho[1,2-b]pyran-4-one, 3-acetyl-2-methyl-

4H-Naphtho[1,2-b]pyran-4-one, 3-acetyl-2-methyl-

C16H12O3 (252.0786)


   

4-(Acetylamino)-3-[(hydroxyacetyl)amino]benzoic acid

4-(Acetylamino)-3-[(hydroxyacetyl)amino]benzoic acid

C11H12N2O5 (252.0746)


   

(5r)-2-[(2-Fluorophenyl)amino]-5-(1-Methylethyl)-1,3-Thiazol-4(5h)-One

(5r)-2-[(2-Fluorophenyl)amino]-5-(1-Methylethyl)-1,3-Thiazol-4(5h)-One

C12H13FN2OS (252.0733)


   

4-(Acetylamino)-3-[(aminoacetyl)amino]benzoic acid

4-(Acetylamino)-3-[(aminoacetyl)amino]benzoic acid

C11H14N3O4+ (252.0984)


   

Benzo[b]fluoranthene

Benzo[b]fluoranthene

C20H12 (252.0939)


   

ACon1_000249

5-18-02-00257 (Beilstein Handbook Reference)

C16H12O3 (252.0786)


   

AIDS-126400

7-Hydroxy-2-methyl-3-phenyl-4H-chromen-4-one

C16H12O3 (252.0786)


   

cycasin

cycasin

C8H16N2O7 (252.0957)


Alkaloid from seeds of the false sago Cycas circinalis and sago cycas Cycas revoluta (Cycadaceae). Carcinogen of significance in human nutrition; but in practice the toxin is present in the seeds of the plant and the pith is used as a food source

   
   

(2S,3S,6R)-6-(4-amino-2-oxopyrimidin-1-yl)-3-azaniumyl-3,6-dihydro-2H-pyran-2-carboxylate

(2S,3S,6R)-6-(4-amino-2-oxopyrimidin-1-yl)-3-azaniumyl-3,6-dihydro-2H-pyran-2-carboxylate

C10H12N4O4 (252.0859)


   

7-Imino-5-methylphenazine-1-carboxylate

7-Imino-5-methylphenazine-1-carboxylate

C14H10N3O2- (252.0773)


   

(R)-N-formyl-beta-hydroxy-L-kynurenine

(R)-N-formyl-beta-hydroxy-L-kynurenine

C11H12N2O5 (252.0746)


   

4aalpha,8aalpha-Dimethyl-4a,4balpha,8a,8balpha-tetrahydrocyclobuta[1,2-d:3,4-d]dipyrimidine-2,4,6,8(1H,3H,5H,7H)-tetraone

4aalpha,8aalpha-Dimethyl-4a,4balpha,8a,8balpha-tetrahydrocyclobuta[1,2-d:3,4-d]dipyrimidine-2,4,6,8(1H,3H,5H,7H)-tetraone

C10H12N4O4 (252.0859)


   

(2S,3R)-2-amino-4-(2-formamidophenyl)-3-hydroxy-4-oxobutanoic acid

(2S,3R)-2-amino-4-(2-formamidophenyl)-3-hydroxy-4-oxobutanoic acid

C11H12N2O5 (252.0746)


   

9-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one

9-[3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one

C10H12N4O4 (252.0859)


   

[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl] propanoate

[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl] propanoate

C9H16O8 (252.0845)


   

[(2R,3S,4R,5R)-3,4,5,6-Tetrahydroxy-1-oxohexan-2-yl] 2-hydroxypropanoate

[(2R,3S,4R,5R)-3,4,5,6-Tetrahydroxy-1-oxohexan-2-yl] 2-hydroxypropanoate

C9H16O8 (252.0845)


   

(Methyl-ONN-azoxy)methyl beta-D-glucopyranoside

(Methyl-ONN-azoxy)methyl beta-D-glucopyranoside

C8H16N2O7 (252.0957)


D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009498 - Neurotoxins

   

Sinapyl acetate

Sinapyl acetate

C13H16O5 (252.0998)


   

(R)-7-Hydroxy-3-((S)-1-hydroxyethyl)-5-methoxy-3,4-dimethylisobenzofuran-1(3H)-one

(R)-7-Hydroxy-3-((S)-1-hydroxyethyl)-5-methoxy-3,4-dimethylisobenzofuran-1(3H)-one

C13H16O5 (252.0998)


A natural product found in Leptosphaeria species.

   

4-(2-chloro-6-fluorobenzyl)-1,3,5-trimethyl-1H-pyrazole

4-(2-chloro-6-fluorobenzyl)-1,3,5-trimethyl-1H-pyrazole

C13H14ClFN2 (252.0829)


   

2-[[2-(3,4-Dimethylanilino)-2-oxoethyl]thio]acetamide

2-[[2-(3,4-Dimethylanilino)-2-oxoethyl]thio]acetamide

C12H16N2O2S (252.0932)


   

6,7-dimethoxy-3-propoxy-3H-isobenzofuran-1-one

6,7-dimethoxy-3-propoxy-3H-isobenzofuran-1-one

C13H16O5 (252.0998)


   

Acremostrictin, rel-

Acremostrictin, rel-

C13H16O5 (252.0998)


A natural product found in Acremonium strictum.

   

2-[2,4-Dihydroxy-3-(3-methylbut-2-enyl)phenyl]-2-hydroxyacetic acid

2-[2,4-Dihydroxy-3-(3-methylbut-2-enyl)phenyl]-2-hydroxyacetic acid

C13H16O5 (252.0998)


   

2-[2,4,6-Trihydroxy-3-(3-methylbut-2-enyl)phenyl]acetic acid

2-[2,4,6-Trihydroxy-3-(3-methylbut-2-enyl)phenyl]acetic acid

C13H16O5 (252.0998)


   

5-Hydroxybenzo[b][1]benzazepine-11-carboxamide

5-Hydroxybenzo[b][1]benzazepine-11-carboxamide

C15H12N2O2 (252.0899)


   

Methyl trimethylsilyl phthalate

Methyl trimethylsilyl phthalate

C12H16O4Si (252.0818)


   

2-[4-(4-Cyanophenyl)phenoxy]acetamide

2-[4-(4-Cyanophenyl)phenoxy]acetamide

C15H12N2O2 (252.0899)


   

Benzoic acid, 4-acetyloxy-, trimethylsilyl ester

Benzoic acid, 4-acetyloxy-, trimethylsilyl ester

C12H16O4Si (252.0818)


   

Methyl trimethylsilyl isophthalate

Methyl trimethylsilyl isophthalate

C12H16O4Si (252.0818)


   

1,4-Benzenedicarboxylic acid, methyl trimethylsilyl ester

1,4-Benzenedicarboxylic acid, methyl trimethylsilyl ester

C12H16O4Si (252.0818)


   

4-Methoxybenzoylformic acid, TMS

4-Methoxybenzoylformic acid, TMS

C12H16O4Si (252.0818)


   

3,4-Methylenedioxyphenylacetic acid, trimethylsilyl ester

3,4-Methylenedioxyphenylacetic acid, trimethylsilyl ester

C12H16O4Si (252.0818)


   

(Z)-1-(3-Nitrophenyl)-ethanone trimethylsilyloxime

(Z)-1-(3-Nitrophenyl)-ethanone trimethylsilyloxime

C11H16N2O3Si (252.093)


   

(E)-1-(3-Nitrophenyl)-ethanone trimethylsilyloxime

(E)-1-(3-Nitrophenyl)-ethanone trimethylsilyloxime

C11H16N2O3Si (252.093)


   

Dimethyl trans-2,3,4,5,6,7-hexahydroinden-1(H)-one-5,6-dicarboxylate

Dimethyl trans-2,3,4,5,6,7-hexahydroinden-1(H)-one-5,6-dicarboxylate

C13H16O5 (252.0998)


   

Dimethyl cis-4-acryloyl-4-cyclohexene-1,2-dicarboxylate

Dimethyl cis-4-acryloyl-4-cyclohexene-1,2-dicarboxylate

C13H16O5 (252.0998)


   

Dimethyl cis-2,3,4,5,6,7-hexahydroinden-1(H)-one-5,6-dicarboxylate

Dimethyl cis-2,3,4,5,6,7-hexahydroinden-1(H)-one-5,6-dicarboxylate

C13H16O5 (252.0998)


   

Dimethyl trans-4-acryloyl-4-cyclohexene-1,2-dicarboxylate

Dimethyl trans-4-acryloyl-4-cyclohexene-1,2-dicarboxylate

C13H16O5 (252.0998)


   

2-Deoxyinosine

2-Deoxyinosine

C10H12N4O4 (252.0859)


A purine 2-deoxyribonucleoside that is inosine in which the hydroxy group at position 2 is replaced by a hydrogen. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS 2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency. 2’-deoxyadenosine inhibits the growth of human colon-carcinoma cell lines and is found to be associated with purine nucleoside phosphorylase (PNP) deficiency.

   

2,4,6-Trihydroxy-3-methyl-5-(3-methylbutanoyl)benzaldehyde

2,4,6-Trihydroxy-3-methyl-5-(3-methylbutanoyl)benzaldehyde

C13H16O5 (252.0998)


   

5-hydroxy-N-formyl-L-kynurenine

5-hydroxy-N-formyl-L-kynurenine

C11H12N2O5 (252.0746)


   

1,2-Benzpyrene

1,2-Benzpyrene

C20H12 (252.0939)


   

Benzo[k]fluoranthene

11,12-Benzofluoranthene

C20H12 (252.0939)


   

7-hydroxy-2-methyl-3-phenylchromen-4-one

7-Hydroxy-2-methyl-3-phenyl-4H-chromen-4-one

C16H12O3 (252.0786)


   

2-Hydroxycarbamazepine

2-Hydroxycarbamazepine

C15H12N2O2 (252.0899)


   

Pyridine, 3-(5-(p-methoxyphenyl)-2-oxazolyl)-

Pyridine, 3-(5-(p-methoxyphenyl)-2-oxazolyl)-

C15H12N2O2 (252.0899)


   

3-Hydroxycarbamazepine

3-Hydroxy Carbamazepine

C15H12N2O2 (252.0899)


   

5-Hydroxy-N-formylkynurenine

5-Hydroxy-N-formylkynurenine

C11H12N2O5 (252.0746)


A non-proteinogenic alpha-amino acid that is 5-hydroxykynurenine bearing an N-formyl substituent.

   

4a,4b-dimethylhexahydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetrone

4a,4b-dimethylhexahydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetrone

C10H12N4O4 (252.0859)


A member of the class of cyclobutadipyrimidines that is hexahydro-1,3,6,8-tetraazabiphenylene-2,4,5,7-tetrone carrying two additional methyl substituents at positions 4a and 4b.

   

N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine

N5-(3,4-Dioxo-1,5-cyclohexadien-1-yl)-L-glutamine

C11H12N2O5 (252.0746)


   

Hypoxanthine, 9-(2-deoxy-beta-D-erythro-pentofuranosyl)-

Hypoxanthine, 9-(2-deoxy-beta-D-erythro-pentofuranosyl)-

C10H12N4O4 (252.0859)


   

FK17-P2a

FK17-P2a

C13H16O5 (252.0998)


A dihydroxybenzaldehyde that is 2,4-dihydroxybenzaldehyde which is substituted by a methyl group at position e and by a at positions 3 and 4-hydroxy-2-oxopentyl group at position 6. A fungal metabolite isolated from Pseudobotrytis and Aspergillus niger (stereochemistry not been determined).

   

Methyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate

Methyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate

C13H16O5 (252.0998)


   

2-(4-Hydroxyphenyl)-3-benzofuranyl methyl ketone

1-[2-(4-Hydroxyphenyl)-1-benzofuran-3-yl]ethanone

C16H12O3 (252.0786)


   

(2-Chlorophenyl)diphenylmethane

(2-Chlorophenyl)diphenylmethane

C14H17ClO2 (252.0917)


   

Chlorophenyl)diphenylmethane

Chlorophenyl)diphenylmethane

C14H17ClO2 (252.0917)


   

Hydroxy-N-formylkynurenine

Hydroxy-N-formylkynurenine

C11H12N2O5 (252.0746)


   
   

3-Hydroxy-6-methylflavone

3-Hydroxy-6-methylflavone

C16H12O3 (252.0786)


   

Methoxyisoflavone

Methoxyisoflavone

C16H12O3 (252.0786)


   

4'-O-Methylisoflavone

4'-O-Methylisoflavone

C16H12O3 (252.0786)


   

O-Methylisoflavone

O-Methylisoflavone

C16H12O3 (252.0786)


   

3'-Deoxyinosine

3'-Deoxyinosine

C10H12N4O4 (252.0859)


3'-Deoxyinosine 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].

   

(2s)-2-[(3,4-dioxocyclohexa-1,5-dien-1-yl)amino]-4-(c-hydroxycarbonimidoyl)butanoic acid

(2s)-2-[(3,4-dioxocyclohexa-1,5-dien-1-yl)amino]-4-(c-hydroxycarbonimidoyl)butanoic acid

C11H12N2O5 (252.0746)


   

3-ethoxy-4-(hydroxymethyl)-7-methoxy-6-methyl-3h-2-benzofuran-1-one

3-ethoxy-4-(hydroxymethyl)-7-methoxy-6-methyl-3h-2-benzofuran-1-one

C13H16O5 (252.0998)


   

10-ethenyl-8-hydroxy-9-methylbenzo[f]chromen-3-one

10-ethenyl-8-hydroxy-9-methylbenzo[f]chromen-3-one

C16H12O3 (252.0786)


   

(1z)-1-methyl-2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)diazen-1-ium-1-olate

(1z)-1-methyl-2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)diazen-1-ium-1-olate

C8H16N2O7 (252.0957)


   

1,2-dihydroxy-4,8,11-trimethyl-9-oxatricyclo[6.2.1.0²,⁶]undec-4-ene-3,10-dione

1,2-dihydroxy-4,8,11-trimethyl-9-oxatricyclo[6.2.1.0²,⁶]undec-4-ene-3,10-dione

C13H16O5 (252.0998)


   

(3r,4r,5s)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-2-one

(3r,4r,5s)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-2-one

C13H16O5 (252.0998)


   

methyl 3-(2,4,5-trimethoxyphenyl)prop-2-enoate

methyl 3-(2,4,5-trimethoxyphenyl)prop-2-enoate

C13H16O5 (252.0998)


   

3-hydroxy-4-methoxy-2-methyl-7-(prop-1-en-1-yl)-2h,3h,4h-pyrano[4,3-b]pyran-5-one

3-hydroxy-4-methoxy-2-methyl-7-(prop-1-en-1-yl)-2h,3h,4h-pyrano[4,3-b]pyran-5-one

C13H16O5 (252.0998)


   

(3s,4r)-4,8-dihydroxy-6-methoxy-3,4,5-trimethyl-3h-2-benzopyran-1-one

(3s,4r)-4,8-dihydroxy-6-methoxy-3,4,5-trimethyl-3h-2-benzopyran-1-one

C13H16O5 (252.0998)


   

(3s)-3-ethyl-5,6,7-trimethoxy-3h-2-benzofuran-1-one

(3s)-3-ethyl-5,6,7-trimethoxy-3h-2-benzofuran-1-one

C13H16O5 (252.0998)


   

1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]but-2-en-1-one

1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]but-2-en-1-one

C13H16O5 (252.0998)


   

3-[3-(2h-1,3-benzodioxol-5-yl)phenyl]prop-2-enal

3-[3-(2h-1,3-benzodioxol-5-yl)phenyl]prop-2-enal

C16H12O3 (252.0786)


   

(4s,6s)-6-[(1s,2s)-1,2-dihydroxy-2-phenylethyl]-4-hydroxyoxan-2-one

(4s,6s)-6-[(1s,2s)-1,2-dihydroxy-2-phenylethyl]-4-hydroxyoxan-2-one

C13H16O5 (252.0998)


   

2-amino-4-{5-hydroxy-2-[(hydroxymethylidene)amino]phenyl}-4-oxobutanoic acid

2-amino-4-{5-hydroxy-2-[(hydroxymethylidene)amino]phenyl}-4-oxobutanoic acid

C11H12N2O5 (252.0746)


   

(3r)-8-hydroxy-3-(3-hydroxypropyl)-7-methoxy-3,4-dihydro-2-benzopyran-1-one

(3r)-8-hydroxy-3-(3-hydroxypropyl)-7-methoxy-3,4-dihydro-2-benzopyran-1-one

C13H16O5 (252.0998)


   

1-{4-acetyl-9h-pyrido[3,4-b]indol-8-yl}ethanone

1-{4-acetyl-9h-pyrido[3,4-b]indol-8-yl}ethanone

C15H12N2O2 (252.0899)


   

6,8-dihydroxy-3-methoxy-3,5,7-trimethyl-4h-2-benzopyran-1-one

6,8-dihydroxy-3-methoxy-3,5,7-trimethyl-4h-2-benzopyran-1-one

C13H16O5 (252.0998)


   

3,8-dihydroxy-6-methoxy-3,4,5-trimethyl-4h-2-benzopyran-1-one

3,8-dihydroxy-6-methoxy-3,4,5-trimethyl-4h-2-benzopyran-1-one

C13H16O5 (252.0998)


   

1-o-coumaroylglycerol; (s,e)-form,4'-me ether

NA

C13H16O5 (252.0998)


{"Ingredient_id": "HBIN002873","Ingredient_name": "1-o-coumaroylglycerol; (s,e)-form,4'-me ether","Alias": "NA","Ingredient_formula": "C13H16O5","Ingredient_Smile": "NA","Ingredient_weight": "252.26","OB_score": "NA","CAS_id": "220852-57-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9135","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-hydroxy-3-methylanthraquinone; me ether

NA

C16H12O3 (252.0786)


{"Ingredient_id": "HBIN005746","Ingredient_name": "2-hydroxy-3-methylanthraquinone; me ether","Alias": "NA","Ingredient_formula": "C16H12O3","Ingredient_Smile": "NA","Ingredient_weight": "252.26","OB_score": "NA","CAS_id": "17241-42-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8619","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-o-coumaroylglycerol; (e)-form,4'-me ether

NA

C13H16O5 (252.0998)


{"Ingredient_id": "HBIN006216","Ingredient_name": "2-o-coumaroylglycerol; (e)-form,4'-me ether","Alias": "NA","Ingredient_formula": "C13H16O5","Ingredient_Smile": "NA","Ingredient_weight": "252.26","OB_score": "NA","CAS_id": "220852-58-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8540","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-hydroxy-2-(2,4,5-trimethoxyphenyl)-2e-butenal

NA

C13H16O5 (252.0998)


{"Ingredient_id": "HBIN010432","Ingredient_name": "4-hydroxy-2-(2,4,5-trimethoxyphenyl)-2e-butenal","Alias": "NA","Ingredient_formula": "C13H16O5","Ingredient_Smile": "CC(=O)CC(=O)C1=C(C=C(C=C1OC)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10800","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(2e)-3-(2,3,4,5-tetramethoxyphenyl)prop-2-enal

(2e)-3-(2,3,4,5-tetramethoxyphenyl)prop-2-enal

C13H16O5 (252.0998)


   

(3r,4s)-8-hydroxy-3-(hydroxymethyl)-6-methoxy-4,5-dimethyl-3,4-dihydro-2-benzopyran-1-one

(3r,4s)-8-hydroxy-3-(hydroxymethyl)-6-methoxy-4,5-dimethyl-3,4-dihydro-2-benzopyran-1-one

C13H16O5 (252.0998)


   

(3ar,4r,8as,8br)-3a,4-dihydroxy-6,8b-dimethyl-1h,4h,5h,8h,8ah-indeno[4,5-c]furan-3,7-dione

(3ar,4r,8as,8br)-3a,4-dihydroxy-6,8b-dimethyl-1h,4h,5h,8h,8ah-indeno[4,5-c]furan-3,7-dione

C13H16O5 (252.0998)


   

(3s,4s)-4,8-dihydroxy-6-methoxy-3,4,5-trimethyl-3h-2-benzopyran-1-one

(3s,4s)-4,8-dihydroxy-6-methoxy-3,4,5-trimethyl-3h-2-benzopyran-1-one

C13H16O5 (252.0998)


   

(3s)-3-hydroxy-6,7-dimethoxy-2,2-dimethyl-3h-1-benzopyran-4-one

(3s)-3-hydroxy-6,7-dimethoxy-2,2-dimethyl-3h-1-benzopyran-4-one

C13H16O5 (252.0998)


   

7-hydroxy-3-(1-hydroxyethyl)-5-methoxy-3,4-dimethyl-2-benzofuran-1-one

7-hydroxy-3-(1-hydroxyethyl)-5-methoxy-3,4-dimethyl-2-benzofuran-1-one

C13H16O5 (252.0998)


   

(2e)-1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]but-2-en-1-one

(2e)-1-[2,4-dihydroxy-3-(2-hydroxyethyl)-6-methoxyphenyl]but-2-en-1-one

C13H16O5 (252.0998)


   

(4r)-4,8-dihydroxy-7-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

(4r)-4,8-dihydroxy-7-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

C13H16O5 (252.0998)


   

7-hydroxy-2,3-bis(hydroxymethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

7-hydroxy-2,3-bis(hydroxymethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

C13H16O5 (252.0998)


   

3-[(3s)-3-carboxy-3-methylpropyl]-4-methoxybenzoic acid

3-[(3s)-3-carboxy-3-methylpropyl]-4-methoxybenzoic acid

C13H16O5 (252.0998)


   

(3s,4s)-7-ethyl-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

(3s,4s)-7-ethyl-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

C13H16O5 (252.0998)


   

6-hydroxy-1-(2,4,5-trihydroxy-3-methylphenyl)hex-4-en-1-one

6-hydroxy-1-(2,4,5-trihydroxy-3-methylphenyl)hex-4-en-1-one

C13H16O5 (252.0998)


   

(3r)-6-(hydroxymethyl)-7,8-dimethoxy-3-methyl-3,4-dihydro-2-benzopyran-1-one

(3r)-6-(hydroxymethyl)-7,8-dimethoxy-3-methyl-3,4-dihydro-2-benzopyran-1-one

C13H16O5 (252.0998)


   

3-ethyl-5,6,7-trimethoxy-3h-2-benzofuran-1-one

3-ethyl-5,6,7-trimethoxy-3h-2-benzofuran-1-one

C13H16O5 (252.0998)


   

4-[(3s)-3-hydroxybutanoyl]-3-methoxy-5-methylbenzoic acid

4-[(3s)-3-hydroxybutanoyl]-3-methoxy-5-methylbenzoic acid

C13H16O5 (252.0998)


   

10-ethenyl-8-hydroxy-7-methylbenzo[f]chromen-3-one

10-ethenyl-8-hydroxy-7-methylbenzo[f]chromen-3-one

C16H12O3 (252.0786)


   

(3s)-3-(acetyloxy)-5-(4-hydroxyphenyl)pentanoic acid

(3s)-3-(acetyloxy)-5-(4-hydroxyphenyl)pentanoic acid

C13H16O5 (252.0998)


   

2,4-dihydroxy-3-(2-hydroxy-3-methylbut-3-en-1-yl)-6-methoxybenzaldehyde

2,4-dihydroxy-3-(2-hydroxy-3-methylbut-3-en-1-yl)-6-methoxybenzaldehyde

C13H16O5 (252.0998)


   

(2e)-3-{4-[(1,3-dihydroxypropan-2-yl)oxy]-3-methoxyphenyl}prop-2-enal

(2e)-3-{4-[(1,3-dihydroxypropan-2-yl)oxy]-3-methoxyphenyl}prop-2-enal

C13H16O5 (252.0998)


   

(4r,6r)-6-[(1s,2r)-1,2-dihydroxy-2-phenylethyl]-4-hydroxyoxan-2-one

(4r,6r)-6-[(1s,2r)-1,2-dihydroxy-2-phenylethyl]-4-hydroxyoxan-2-one

C13H16O5 (252.0998)


   

4,8-dihydroxy-7-(1-hydroxyethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

4,8-dihydroxy-7-(1-hydroxyethyl)-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

C13H16O5 (252.0998)


   

4-[(2r)-2-hydroxybutanoyl]-3-methoxy-5-methylbenzoic acid

4-[(2r)-2-hydroxybutanoyl]-3-methoxy-5-methylbenzoic acid

C13H16O5 (252.0998)


   

3-(acetyloxy)-5-(4-hydroxyphenyl)pentanoic acid

3-(acetyloxy)-5-(4-hydroxyphenyl)pentanoic acid

C13H16O5 (252.0998)


   

(2s,3r,4s,5s)-2-(hydroxymethyl)-5-(purin-9-yl)oxolane-3,4-diol

(2s,3r,4s,5s)-2-(hydroxymethyl)-5-(purin-9-yl)oxolane-3,4-diol

C10H12N4O4 (252.0859)


   

5,5-dimethyl-4,13-diazatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-1,3,6,8,10,12(15),13-heptaene-3,14-diol

5,5-dimethyl-4,13-diazatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-1,3,6,8,10,12(15),13-heptaene-3,14-diol

C15H12N2O2 (252.0899)


   

13-hydroxy-7,17-diazatetracyclo[8.7.0.0³,⁷.0¹¹,¹⁶]heptadeca-1(10),3,5,11,13,15-hexaen-2-one

13-hydroxy-7,17-diazatetracyclo[8.7.0.0³,⁷.0¹¹,¹⁶]heptadeca-1(10),3,5,11,13,15-hexaen-2-one

C15H12N2O2 (252.0899)


   

(2r)-2-{[(2r,3s,4r,5r,6s)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}propanoic acid

(2r)-2-{[(2r,3s,4r,5r,6s)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}propanoic acid

C9H16O8 (252.0845)


   

{5-[(dimethylamino)methyl]-2-iminoimidazolidin-1-yl}oxy(methoxy)phosphinic acid

{5-[(dimethylamino)methyl]-2-iminoimidazolidin-1-yl}oxy(methoxy)phosphinic acid

C7H17N4O4P (252.0987)


   

2-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}propanoic acid

2-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}propanoic acid

C9H16O8 (252.0845)


   

inosine, 2'-deoxy-

inosine, 2'-deoxy-

C10H12N4O4 (252.0859)


   

2,7-dihydroxy-8-methylphenanthrene-4-carbaldehyde

2,7-dihydroxy-8-methylphenanthrene-4-carbaldehyde

C16H12O3 (252.0786)


   

2-[(3,4-dioxocyclohexa-1,5-dien-1-yl)amino]-4-(c-hydroxycarbonimidoyl)butanoic acid

2-[(3,4-dioxocyclohexa-1,5-dien-1-yl)amino]-4-(c-hydroxycarbonimidoyl)butanoic acid

C11H12N2O5 (252.0746)


   

(3r)-3-(hydroxymethyl)-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

(3r)-3-(hydroxymethyl)-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C15H12N2O2 (252.0899)


   

2'-deoxy-inosine

2'-deoxy-inosine

C10H12N4O4 (252.0859)


   

3-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

3-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C15H12N2O2 (252.0899)


   

2-[(4-hydroxyphenyl)methyl]quinazolin-4-ol

2-[(4-hydroxyphenyl)methyl]quinazolin-4-ol

C15H12N2O2 (252.0899)


   

(3r)-3-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

(3r)-3-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C15H12N2O2 (252.0899)


   

1-methoxy-3-methylanthracene-9,10-dione

1-methoxy-3-methylanthracene-9,10-dione

C16H12O3 (252.0786)


   

2-[(1e)-3-oxoprop-1-en-1-yl]phenyl benzoate

2-[(1e)-3-oxoprop-1-en-1-yl]phenyl benzoate

C16H12O3 (252.0786)


   

benzopyrene

benzopyrene

C20H12 (252.0939)


   

(5s)-3-hydroxy-4,5-diphenyl-5h-furan-2-one

(5s)-3-hydroxy-4,5-diphenyl-5h-furan-2-one

C16H12O3 (252.0786)


   

5-methoxy-2-phenylchromen-7-one

5-methoxy-2-phenylchromen-7-one

C16H12O3 (252.0786)


   

2-(3-methoxyphenyl)chromen-4-one

2-(3-methoxyphenyl)chromen-4-one

C16H12O3 (252.0786)


   

10-ethenyl-9-(hydroxymethyl)benzo[f]chromen-3-one

10-ethenyl-9-(hydroxymethyl)benzo[f]chromen-3-one

C16H12O3 (252.0786)


   

[(5s)-5-[(dimethylamino)methyl]-2-iminoimidazolidin-1-yl]oxy(methoxy)phosphinic acid

[(5s)-5-[(dimethylamino)methyl]-2-iminoimidazolidin-1-yl]oxy(methoxy)phosphinic acid

C7H17N4O4P (252.0987)


   

2-methoxy-7-methylanthracene-9,10-dione

2-methoxy-7-methylanthracene-9,10-dione

C16H12O3 (252.0786)


   

3-(hydroxymethyl)-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

3-(hydroxymethyl)-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C15H12N2O2 (252.0899)


   

3-hydroxy-6,7-dimethoxy-2,2-dimethyl-3h-1-benzopyran-4-one

3-hydroxy-6,7-dimethoxy-2,2-dimethyl-3h-1-benzopyran-4-one

C13H16O5 (252.0998)


   

(3r)-8-hydroxy-6,7-dimethoxy-3,5-dimethyl-3,4-dihydro-2-benzopyran-1-one

(3r)-8-hydroxy-6,7-dimethoxy-3,5-dimethyl-3,4-dihydro-2-benzopyran-1-one

C13H16O5 (252.0998)


   

(4r,5s,6r,9r,10r)-4,9,10-trihydroxy-3-methylidene-6-[(1e)-prop-1-en-1-yl]-2-oxaspiro[4.5]dec-7-en-1-one

(4r,5s,6r,9r,10r)-4,9,10-trihydroxy-3-methylidene-6-[(1e)-prop-1-en-1-yl]-2-oxaspiro[4.5]dec-7-en-1-one

C13H16O5 (252.0998)


   

(2s,3s,4r)-3-hydroxy-4-methoxy-2-methyl-7-[(1e)-prop-1-en-1-yl]-2h,3h,4h-pyrano[4,3-b]pyran-5-one

(2s,3s,4r)-3-hydroxy-4-methoxy-2-methyl-7-[(1e)-prop-1-en-1-yl]-2h,3h,4h-pyrano[4,3-b]pyran-5-one

C13H16O5 (252.0998)


   

13-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

13-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C15H12N2O2 (252.0899)


   

4-(ethoxymethyl)-5-hydroxy-7-methoxy-6-methyl-3h-2-benzofuran-1-one

4-(ethoxymethyl)-5-hydroxy-7-methoxy-6-methyl-3h-2-benzofuran-1-one

C13H16O5 (252.0998)


   

(3r,4ar,7s,7as)-3-hydroxy-4'-[(1s)-1-hydroxyethyl]-3,4,4a,7a-tetrahydro-1h-spiro[cyclopenta[c]pyran-7,2'-furan]-5'-one

(3r,4ar,7s,7as)-3-hydroxy-4'-[(1s)-1-hydroxyethyl]-3,4,4a,7a-tetrahydro-1h-spiro[cyclopenta[c]pyran-7,2'-furan]-5'-one

C13H16O5 (252.0998)


   

2,5-dihydroxy-2-isopropyl-7-methoxy-3h-1-benzopyran-4-one

2,5-dihydroxy-2-isopropyl-7-methoxy-3h-1-benzopyran-4-one

C13H16O5 (252.0998)


   

1-hydroxy-2,3-dimethylanthracene-9,10-dione

1-hydroxy-2,3-dimethylanthracene-9,10-dione

C16H12O3 (252.0786)


   

methyl (2z)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

methyl (2z)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate

C13H16O5 (252.0998)


   

4-(3-hydroxybutanoyl)-3-methoxy-5-methylbenzoic acid

4-(3-hydroxybutanoyl)-3-methoxy-5-methylbenzoic acid

C13H16O5 (252.0998)


   

(4r)-4,8-dihydroxy-7-[(1r)-1-hydroxyethyl]-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

(4r)-4,8-dihydroxy-7-[(1r)-1-hydroxyethyl]-6-methoxy-3,4-dihydro-2h-naphthalen-1-one

C13H16O5 (252.0998)


   

(4r,6r)-6-[(1r,2r)-1,2-dihydroxy-2-phenylethyl]-4-hydroxyoxan-2-one

(4r,6r)-6-[(1r,2r)-1,2-dihydroxy-2-phenylethyl]-4-hydroxyoxan-2-one

C13H16O5 (252.0998)


   

3-{4-[(1,3-dihydroxypropan-2-yl)oxy]-3-methoxyphenyl}prop-2-enal

3-{4-[(1,3-dihydroxypropan-2-yl)oxy]-3-methoxyphenyl}prop-2-enal

C13H16O5 (252.0998)


   

methyl 2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)benzoate

methyl 2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)benzoate

C13H16O5 (252.0998)


   

4-(2-hydroxybutanoyl)-3-methoxy-5-methylbenzoic acid

4-(2-hydroxybutanoyl)-3-methoxy-5-methylbenzoic acid

C13H16O5 (252.0998)


   

4'-methoxyisoflavone

4'-methoxyisoflavone

C16H12O3 (252.0786)


   

12-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

12-methoxy-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-5,7,9(16),10(15),11,13-hexaen-2-one

C15H12N2O2 (252.0899)


   

ethyl 3-(7-methoxy-2h-1,3-benzodioxol-5-yl)propanoate

ethyl 3-(7-methoxy-2h-1,3-benzodioxol-5-yl)propanoate

C13H16O5 (252.0998)


   

2,3,4-trihydroxybutyl (2e)-3-phenylprop-2-enoate

2,3,4-trihydroxybutyl (2e)-3-phenylprop-2-enoate

C13H16O5 (252.0998)