Exact Mass: 278.1518012
Exact Mass Matches: 278.1518012
Found 500 metabolites which its exact mass value is equals to given mass value 278.1518012,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Dibutyl phthalate
Di-n-phtalate is a manufactured chemical that does not occur naturally. It is an odorless and oily liquid that is colorless to faint yellow in color. It is slightly soluble in water and does not evaporate easily. Di-n-phtalate is used to make plastics more flexible and is also in carpet backings, paints, glue, insect repellents, hair spray, nail polish, and rocket fuel. N-butyl phthalate is a colorless oily liquid. It is insoluble in water. The primary hazard is the threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since it is a liquid it can easily penetrate the soil and contaminate groundwater and nearby streams. It is combustible though it may take some effort to ignite. It is used in paints and plastics and as a reaction media for chemical reactions. Dibutyl phthalate is a phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of butan-1-ol. Although used extensively as a plasticiser, it is a ubiquitous environmental contaminant that poses a risk to humans. It has a role as an environmental contaminant, a teratogenic agent, a plasticiser, a metabolite and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a phthalate ester and a diester. It is functionally related to a butan-1-ol. Dibutyl phthalate is used in making flexible plastics that are found in a variety of consumer products. It appears to have relatively low acute (short-term) and chronic (long-term) toxicity. No information is available regarding the effects in humans from inhalation or oral exposure to dibutyl phthalate, and only minimal effects have been noted in animals exposed by inhalation. No studies are available on the reproductive, developmental, or carcinogenic effects of dibutyl phthalate in humans. Animal studies have reported developmental and reproductive effects from oral exposure. EPA has classified dibutyl phthalate as a Group D, not classifiable as to human carcinogenicity. Dibutyl phthalate is a natural product found in Scutellaria amoena, Eleutherococcus sessiliflorus, and other organisms with data available. Dibutyl phthalate is found in cloves. DBP was added to the California Proposition 65 (1986) list of suspected teratogens in November 2006. It is a suspected endocrine disruptor. It was used in some nail polishes; all major producers began eliminating this chemical from nail polishes in the Fall of 2006. Dibutyl phthalate (DBP) is a commonly used plasticizer. It is also used as an additive to adhesives or printing inks. It is soluble in various organic solvents, e.g. in alcohol, ether and benzene. DBP is also used as an ectoparasiticide. A plasticizer used in most plastics and found in water, air, soil, plants and animals. It may have some adverse effects with long-term exposure. DBP was added to the California Proposition 65 (1986) list of suspected teratogens in November 2006. It is a suspected endocrine disruptor. It was used in some nail polishes; all major producers began eliminating this chemical from nail polishes in the Fall of 2006.; Dibutyl phthalate (DBP) is a commonly used plasticizer. It is also used as an additive to adhesives or printing inks. It is soluble in various organic solvents, e.g. in alcohol, ether and benzene. DBP is also used as an ectoparasiticide. Dibutyl phthalate is found in kohlrabi and cloves. Dibutyl phthalate is found in cloves. DBP was added to the California Proposition 65 (1986) list of suspected teratogens in November 2006. It is a suspected endocrine disruptor. It was used in some nail polishes; all major producers began eliminating this chemical from nail polishes in the Fall of 2006. Dibutyl phthalate (DBP) is a commonly used plasticizer. It is also used as an additive to adhesives or printing inks. It is soluble in various organic solvents, e.g. in alcohol, ether and benzene. DBP is also used as an ectoparasiticide. A phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of butan-1-ol. Although used extensively as a plasticiser, it is a ubiquitous environmental contaminant that poses a risk to humans. P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03B - Insecticides and repellents D010968 - Plasticizers ATC code: P03BX03 CONFIDENCE standard compound; INTERNAL_ID 823; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10079; ORIGINAL_PRECURSOR_SCAN_NO 10075 CONFIDENCE standard compound; INTERNAL_ID 823; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10082; ORIGINAL_PRECURSOR_SCAN_NO 10080 CONFIDENCE standard compound; INTERNAL_ID 823; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10083; ORIGINAL_PRECURSOR_SCAN_NO 10080 CONFIDENCE standard compound; INTERNAL_ID 823; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10016; ORIGINAL_PRECURSOR_SCAN_NO 10013 CONFIDENCE standard compound; INTERNAL_ID 823; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10065; ORIGINAL_PRECURSOR_SCAN_NO 10063 CONFIDENCE standard compound; INTERNAL_ID 823; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10036; ORIGINAL_PRECURSOR_SCAN_NO 10031 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3670 EAWAG_UCHEM_ID 3670; CONFIDENCE standard compound INTERNAL_ID 4180; CONFIDENCE standard compound CONFIDENCE standard compound; INTERNAL_ID 4180 CONFIDENCE standard compound; INTERNAL_ID 8224 CONFIDENCE standard compound; INTERNAL_ID 199
Monoethylhexyl phthalic acid
Monoethylhexyl phthalic acid (MEHP) is an active metabolite of Bis(2-ethylhexyl)phthalate (DEHP). DEHP measured from the blood of pregnant women have been significantly associated with the decreased penis width, shorter anogenital distance, and the incomplete descent of testes of their newborn sons, replicating effects identified in animals(Wikipedia). DEHP hydrolyzes to MEHP via the enzyme Bis(2-ethylhexyl)phthalate acylhydrolase(3.1.1.60)and subsequently to phthalate salts. The released alcohol is susceptible to oxidation to the aldehyde and carboxylic acid. Monoethylhexyl phthalic acid (MEHP) is an active metabolite of Bis(2-ethylhexyl)phthalate (DEHP). DEHP measured from the blood of pregnant women have been significantly associated with the decreased penis width, shorter anogenital distance, and the incomplete descent of testes of their newborn sons, replicating effects identified in animals. DEHP hydrolyzes to MEHP via the enzyme Bis(2-ethylhexyl)phthalate acylhydrolase(3.1.1.60)and subsequently to phthalate salts. The released alcohol is susceptible to oxidation to the aldehyde and carboxylic acid. [HMDB] CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10026; ORIGINAL_PRECURSOR_SCAN_NO 10023 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4968; ORIGINAL_PRECURSOR_SCAN_NO 4967 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4980; ORIGINAL_PRECURSOR_SCAN_NO 4979 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4973; ORIGINAL_PRECURSOR_SCAN_NO 4971 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9948; ORIGINAL_PRECURSOR_SCAN_NO 9944 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9960; ORIGINAL_PRECURSOR_SCAN_NO 9957 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9947; ORIGINAL_PRECURSOR_SCAN_NO 9946 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9930; ORIGINAL_PRECURSOR_SCAN_NO 9925 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4975; ORIGINAL_PRECURSOR_SCAN_NO 4972 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4995; ORIGINAL_PRECURSOR_SCAN_NO 4994 CONFIDENCE standard compound; INTERNAL_ID 1238; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4973; ORIGINAL_PRECURSOR_SCAN_NO 4969 Phthalic acid mono-2-ethylhexyl ester (MEHP) is a major bioactive metabolite of diethylhexyl phthalate (DEHP), which inhibits the 17, 20 lyase activity of CYP17[1]. Phthalic acid mono-2-ethylhexyl ester (MEHP) is a major bioactive metabolite of diethylhexyl phthalate (DEHP), which inhibits the 17, 20 lyase activity of CYP17[1].
OXADIXYL
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3100 CONFIDENCE standard compound; INTERNAL_ID 525; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7509; ORIGINAL_PRECURSOR_SCAN_NO 7506 CONFIDENCE standard compound; INTERNAL_ID 525; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7589; ORIGINAL_PRECURSOR_SCAN_NO 7585 CONFIDENCE standard compound; INTERNAL_ID 525; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7575; ORIGINAL_PRECURSOR_SCAN_NO 7571 CONFIDENCE standard compound; INTERNAL_ID 525; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7572; ORIGINAL_PRECURSOR_SCAN_NO 7568 CONFIDENCE standard compound; INTERNAL_ID 525; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7583; ORIGINAL_PRECURSOR_SCAN_NO 7581 CONFIDENCE standard compound; INTERNAL_ID 525; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7621; ORIGINAL_PRECURSOR_SCAN_NO 7618
Pentoxifylline
Pentoxifylline is only found in individuals that have used or taken this drug. It is a methylxanthine derivative that inhibits phosphodiesterase and affects blood rheology. It improves blood flow by increasing erythrocyte and leukocyte flexibility. It also inhibits platelet aggregation. Pentoxifylline modulates immunologic activity by stimulating cytokine production. [PubChem]Pentoxifylline inhibits erythrocyte phosphodiesterase, resulting in an increase in erythrocyte cAMP activity. Subsequently, the erythrocyte membrane becomes more resistant to deformity. Along with erythrocyte activity, pentoxifylline also decreases blood viscosity by reducing plasma fibrinogen concentrations and increasing fibrinolytic activity. It is also a non selective adenosine receptor antagonist. C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AD - Purine derivatives COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors D020011 - Protective Agents > D011837 - Radiation-Protective Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor D000975 - Antioxidants > D016166 - Free Radical Scavengers D020011 - Protective Agents > D000975 - Antioxidants CONFIDENCE standard compound; INTERNAL_ID 8614 CONFIDENCE standard compound; INTERNAL_ID 2267 Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Diisobutyl phthalate
Di-(2-methylpropyl)-phthalate, also known as dibp or isobutyl phthalate, is a member of the class of compounds known as benzoic acid esters. Benzoic acid esters are ester derivatives of benzoic acid. Di-(2-methylpropyl)-phthalate is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Di-(2-methylpropyl)-phthalate can be found in kohlrabi, which makes di-(2-methylpropyl)-phthalate a potential biomarker for the consumption of this food product. Di-(2-methylpropyl)-phthalate can be found primarily in urine. Di-(2-methylpropyl)-phthalate is a non-carcinogenic (not listed by IARC) potentially toxic compound. Phthalate esters are endocrine disruptors. Animal studies have shown that they disrupt reproductive development and can cause a number of malformations in affected young, such as reduced anogenital distance (AGD), cryptorchidism, hypospadias, and reduced fertility. The combination of effects associated with phthalates is called phthalate syndrome’ (A2883) (T3DB). DIBP is an odorless plasticizer and has excellent heat and light stability. It is the lowest cost plasticizer for cellulose nitrate. DIBP has lower density and freezing point than DBP (dibutyl phthalate, CAS No.: 84-74-2). It has similar properties as dibutyl phthalate and can be used as a substitute for it. CONFIDENCE standard compound; INTERNAL_ID 1189; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10016; ORIGINAL_PRECURSOR_SCAN_NO 10013 CONFIDENCE standard compound; INTERNAL_ID 1189; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10059; ORIGINAL_PRECURSOR_SCAN_NO 10056 CONFIDENCE standard compound; INTERNAL_ID 1189; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10032; ORIGINAL_PRECURSOR_SCAN_NO 10030 CONFIDENCE standard compound; INTERNAL_ID 1189; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10082; ORIGINAL_PRECURSOR_SCAN_NO 10080 CONFIDENCE standard compound; INTERNAL_ID 1189; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9953; ORIGINAL_PRECURSOR_SCAN_NO 9950 CONFIDENCE standard compound; INTERNAL_ID 1189; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9952; ORIGINAL_PRECURSOR_SCAN_NO 9950
Pantetheine
Pantetheine is the mercaptoethyl conjugated amide analogue of pantothenic acid (Vitamin B5). The dimer of this compound, pantethine is more commonly known, and is considered to be a more potent form of vitamin B5 than pantothenic acid. Pantetheine is an intermediate in the production of Coenzyme A by the body. An intermediate in the pathway of coenzyme A formation in mammalian liver and some microorganisms. Pantetheine is the mercaptoethyl conjugated amide analogue of pantothenic acid (Vitamin B5). The dimer of this compound, pantethine is more commonly known, and is considered to be a more potent form of vitamin B5 than pantothenic acid. Pantetheine is an intermediate in the production of Coenzyme A by the body. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
N1-(alpha-D-ribosyl)-5,6-dimethyl-benzimidazole
N1-(alpha-D-ribosyl)-5,6-dimethyl-benzimidazole is an intermediate in riboflavin metabolism. It is converted from N1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazole via dephosphorylation by the enzyme phosphohistidine phosphatase 1 (EC 3.1.3.-). Humans do not have all the enzymes needed to synthesize or metabolize riboflavin. However, gut microflora do have the necessary enzymatic machinery to produce and metabolize this vitamin. Riboflavin (or vitamin B2) is an easily absorbed micronutrient with a key role in maintaining health in humans and animals. It is the central component of the cofactors FAD and FMN, and is therefore required by all flavoproteins. Riboflavin is yellow or yellow-orange in color and in addition to being used as a food coloring it is also used to fortify some foods including baby foods, breakfast cereals, pastas, sauces, processed cheese, fruit drinks, vitamin-enriched milk products, some energy drinks, and vitamin supplements. [HMDB] N1-(alpha-D-ribosyl)-5,6-dimethyl-benzimidazole is an intermediate in riboflavin metabolism. It is converted from N1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazole via dephosphorylation by the enzyme phosphohistidine phosphatase 1 (EC 3.1.3.-). Humans do not have all the enzymes needed to synthesize or metabolize riboflavin. However, gut microflora do have the necessary enzymatic machinery to produce and metabolize this vitamin. Riboflavin (or vitamin B2) is an easily absorbed micronutrient with a key role in maintaining health in humans and animals. It is the central component of the cofactors FAD and FMN, and is therefore required by all flavoproteins. Riboflavin is yellow or yellow-orange in color and in addition to being used as a food coloring it is also used to fortify some foods including baby foods, breakfast cereals, pastas, sauces, processed cheese, fruit drinks, vitamin-enriched milk products, some energy drinks, and vitamin supplements.
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone is found in alcoholic beverages. 1-(4-Hydroxy-3-methoxyphenyl)-3-decanone is from grains of paradise (Amomum melegueta) and ginger (Zingiber officinale).Paradol is the active flavor constituent of the seeds of Guinea pepper (Aframomum melegueta). The seed is also known as Grains of paradise. Paradol has been found to have antioxidative and antitumor promoting effects. It is used in flavors as an essential oil to give spiciness. (Wikipedia [6]-Paradol is a member of phenols, a ketone and a monomethoxybenzene. Paradol is a natural product found in Aframomum angustifolium, Aframomum melegueta, and Zingiber officinale with data available. From grains of paradise (Amomum melegueta) and ginger (Zingiber officinale) Paradol is a pungent phenolic substance found in ginger and other Zingiberaceae plants. Paradol is an effective inhibitor of tumor promotion in mouse skin carcinogenesis, binds to cyclooxygenase (COX)-2 active site. Paradol is a pungent phenolic substance found in ginger and other Zingiberaceae plants. Paradol is an effective inhibitor of tumor promotion in mouse skin carcinogenesis, binds to cyclooxygenase (COX)-2 active site.
Panaxytriol
Panaxytriol is found in tea. Panaxytriol is found in ginsen Found in ginseng
Phenylalanylisoleucine
C15H22N2O3 (278.16303419999997)
Phenylalanylisoleucine is a dipeptide composed of phenylalanine and isoleucine. 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.
Leucylphenylalanine
C15H22N2O3 (278.16303419999997)
Leucylphenylalanine is a dipeptide composed of leucine and phenylalanine. It is an incomplete breakdown product of protein digestion or protein catabolism. 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. Leucyl-phenylalanine belongs to the class of organic compounds known as dipeptides.
(x)-2-Heptanol glucoside
(x)-2-Heptanol glucoside is found in herbs and spices. (x)-2-Heptanol glucoside occurs in oil of ginger (Zingiber officinale Occurs in oil of ginger (Zingiber officinale). (x)-2-Heptanol glucoside is found in herbs and spices.
(6E)-1-(4-hydroxyphenyl)-7-phenylhepta-4,6-dien-3-one
Longistylin C
Longistylin C is found in pulses. Longistylin C is isolated from Cajanus cajan (pigeon pea). Isolated from Cajanus cajan (pigeon pea). Longistylin C is found in pulses.
8-Acetoxy-4-acoren-3-one
8-Acetoxy-4-acoren-3-one is found in herbs and spices. 8-Acetoxy-4-acoren-3-one is a constituent of Acorus calamus (sweet flag)
Panaxacol
Panaxacol is found in tea. Panaxacol is present in ginseng. Present in ginseng. Panaxacol is found in tea.
Triprolidine
Triprolidine is only found in individuals that have used or taken this drug. It is the first generation histamine H1 antagonist used in allergic rhinitis; asthma; and urticaria. It is a component of cough and cold medicines. It may cause drowsiness. [PubChem]Triprolidine binds to the histamine H1 receptor. This blocks the action of endogenous histamine, which subsequently leads to temporary relief of the negative symptoms brought on by histamine. R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D018926 - Anti-Allergic Agents
Isoleucyl-Phenylalanine
C15H22N2O3 (278.16303419999997)
Isoleucyl-Phenylalanine is a dipeptide composed of isoleucine and phenylalanine. 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Prolyl-Tyrosine
Prolyl-Tyrosine is a dipeptide composed of proline and tyrosine. 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
alpha-CEHC
alpha-Carboxyethyl hydrochroman (alpha-CEHC) has been identified as a major water-soluble metabolite of vitamin E, which circulates in the blood and is excreted in the urine (PMID: 12420750). About one-third of the alpha-CEHC circulating in the blood is present as alpha-CEHC glucuronide (PMID: 10552913). 2,5,7,8-tetramethyl-2-(2-carboxyethyl)-6-hydroxychroman (alpha-CEHC) has been identified as a major water-soluble metabolite of vitamin E, which circulates in the blood and is excreted with the urine. (PMID 12420750) [HMDB]
Phenylalanylhydroxyproline
Phenylalanylhydroxyproline is a proteolytic breakdown product of collagen. It belongs to the family of peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by the formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another. It is found in urine (PMID: 3782411). A dipeptide found in urine (PMID: 3782411). This is a proteolytic breakdown product of collagen. [HMDB]
Tyrosyl-Proline
Tyrosyl-Proline is a dipeptide composed of tyrosine and proline. 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
keratan sulfate I
C15H22N2O3 (278.16303419999997)
keratan sulfate I, also known as Keratan sulfuric acid I or 4-(3-Butoxy-4-methoxybenzyl)-2-imidazolidinone, is classified as a member of the Anisoles. Anisoles are organic compounds containing a methoxybenzene or a derivative thereof. keratan sulfate I is considered to be practically insoluble (in water) and relatively neutral D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors
2-[1-(4-Methylphenyl)-3-(1-pyrrolidinyl)prop-1-enyl]pyridine
3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D020011 - Protective Agents > D000975 - Antioxidants
3-Methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzaldehyde
C15H22N2O3 (278.16303419999997)
4'-Hydroxymethohexital
2,5,7,8-Tetramethyl-2-(2'-carboxyethyl)-6-hydroxychroman
Adibendan
C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor
3-Pyridinecarboximidamide, N-(2-hydroxy-3-(1-piperidinyl)propoxy)-
Cuprizone
D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors D064449 - Sequestering Agents > D002614 - Chelating Agents
Phenylalanylleucine
C15H22N2O3 (278.16303419999997)
Proquazone
M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids 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 D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors
LF
C15H22N2O3 (278.16303419999997)
Leucyl-phenylalanine, also known as (2s,3s)-(2-2h,3-2h)-leucine-(S)-phenylalanine or leu-phe, is a member of the class of compounds known as dipeptides. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Leucyl-phenylalanine is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Leucyl-phenylalanine can be found primarily in blood, feces, and urine. Leucyl-phenylalanine belongs to the class of organic compounds known as dipeptides.
Musk moskene
Flavouring compound [Superscent]
[1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 5-acetate
2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol acetate
[4aR-(4aalpha,5alpha,8abeta,9abeta)]-9a-Ethoxy-4a,5,6,7,8,8a,9,9a-octahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-2(4H)-one
4-epi-7alpha,15-dihydroxypodocarp-8(14)-en-13-one
4alpha,5alpha-Epoxy-3-oxo-4(15)-dihydrocostic acid methyl ester
[1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 4-acetate
[S-[R*,S*-(E)]]-6-[6-(Acetyloxy)-1,5-dimethyl-4-hexenyl]-3-methyl-2-cyclohexen-1-one
Ivangulin
1,5-dihydroxy-1-isopropyl-6-methoxy-4,7-dimethyl-tetralin-2-one
3-[(Acetyloxy)methyl]-6-(1,5-dimethyl-4-hexenyl)-2-cyclohexen-1-one
4beta-Hydroxy-11-O-(2-pyrolylcarboxy)epilupinine
C15H22N2O3 (278.16303419999997)
4beta-O-(2-Pyrrolylcarbonyl)epilupinine
C15H22N2O3 (278.16303419999997)
Emmotin A
5,5-dibutoxy-2,2-bifuran
A ring assembly that consists of 2,2-bifuran substituted by butoxy groups at positions 5 and 5 respectively. It is isolated from the aerial parts of Chrysanthemum coronarium and acts as an inhibitor of human AcylCoA:cholesterol acyltransferase hACAT-1 and hACAT-2.
8-methoxy-9-O-angeloylthymol
A natural product found in Eupatorium cannabinum subspecies asiaticum.
Demexiptiline
C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent > C94727 - Tricyclic Antidepressant
Methyl 2-hydroxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
Santacruzamate A
C15H22N2O3 (278.16303419999997)
Santacruzamate A is an organooxygen compound and an organonitrogen compound. It is functionally related to a gamma-amino acid. santacruzamate A is a natural product found in Cyanobacterium and Symploca with data available. D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors Santacruzamate A (CAY-10683) is a potent and selective HDAC2 inhibitor with an IC50 of 119 pM[1].
Tolycaine
C15H22N2O3 (278.16303419999997)
C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
Lomifylline
C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent > C319 - Bronchodilator C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor
1-[2,6-dihydroxy-4-methoxy-3-(3-methyl-2-butenyl)phenyl]-2-methyl-1-propanone
((1S*,2S*)-1-methoxy-5-(2-methoxyethyl)-2,4,6-trimethyl-2,3-dihydro-1H-inden-2-yl)methanol|applanatine A
1-[2,4-dihydroxy-6-methoxy-3-(3-methyl-2-butenyl)phenyl]-2-methyl-1-propanone
(3aS,5aR,7S,9aS,9bR)-9b-methyl-1-oxo-1,3,3a,5a,6,7,8,9,9a,9b-decahydronaphtho[1,2-c]furan-7-ylmethyl acetate|oblongolide G
1,10-epoxy-8alpha-methoxyeremophilanolide|1beta,10beta-epoxy-8alpha-methoxyeremophil-1,7(11)-en-12,8beta-olide
(3Z,4R)-3-(dodec-11-en-1-ylidene)-4,5-dihydro-4-hydroxy-5-methylidenefuran-2(3H)-one|litsealiicolide B
(E)-2-(4-methoxyphenyl)-3-methyl-5-(prop-1-enyl)benzo[b]furan|2-(4-methoxyphenyl)-3-methyl-5-(E)-propenylbenzofuran|2-(4-methoxyphenyl)-3-methyl-5-[(E)-prop-1-enyl]benzo[b]furan|eupomatenoid-15
2-Methyl-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]butan-1-one
6alpha-methoxy-3-oxo-pinguis-5(10)-ene-11,6-olide|Me ester-6-Hydroxy-3-oxo-5(10)-pinguisen-11, 6-olide
((R)-10-methanesulfinyl-decyl)-thiourea|((R)-10-Methansulfinyl-decyl)-thioharnstoff|(-)-N-<10-Methylsulfinyl-decyl>-thioharnstoff|(R)-1-(10-Methylsulfinyldecyl)-thioharnstoff|N-[10-(omega-Methylsulfinyl)-decyl]-thioharnstoff
(+)-oploxyne A|9,10-epoxyheptadeca-4,6-diyne-3,8-diol|oploxyne A
(1E,4R,4aR,5S,6R,8aR)-5,6-epoxy-4-isopropyl-6-methyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-methanol acetate
1-(3,4-dihydro-5-hydroxy-7-methoxy-2,2-dimethyl-2 h -1-benzopyran-6-yl)-2-methyl-1-propanone
demethoxycarbonyl-3,14,15,16,17,18-hexahydrogambirtannine
1alpha-acetoxy-4alpha,14-epoxy-5,10-bis-epi-eudesma-11(13)-ene|Ac-(1alpha,4alpha,5beta,10alpha)-4,14-Epoxy-11-eudesmen-1-ol
1-Acetoxy-2-isopropenyl-3-methylen-4-isobutyryloxy-cyclohexen-(5)
1beta-hydroxy-6(7),9(10)-dien-8-on-eremophila-12-acid methyl ester
(4S,4aR,5S,9aR)-4a,5,6,7,9,9a-hexahydro-4-hydroxy-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one|6beta-hydroxy-8alpha-methoxyeremophila-(10),7(11)-dien-12,8beta-olide|6beta-hydroxy-8alpha-methoxyeremophila-1(10),7(11)-dien-12,8beta-olide|6??-Hydroxy-8??-methoxyeremophila-1(10),7(11)-dien-12,8??-olide|8-Me ether-6,8-Dihydroxy-1(10),7(11)-eremophiladien-12,8-olide
3,8,8-Trimethyl-4,5-dihydrophenanthro[10,1-bc]pyran-9(8H)-one
5,6,7,8-Tetramethyl-phenanthren-9-carbonsaeure|5,6,7,8-tetramethyl-phenanthrene-9-carboxylic acid
2,2-Dimethyl-5,7-dimethoxy-6-(1-methoxyethyl)-2H-1-benzopyran
1beta-hydroxy-8alpha-methoxyeremophil-7(11),9-dien-8beta,12-olide
1,4-Dimethyl-2-hydroxy-2-(4-methoxybenzyl)piperazine-3,6-dione
(Sp)-1,11-Dioxa-[11]paracyclophan-13-carbonsaeure|(sp)-1,11-dioxa-[11]paracyclophane-13-carboxylic acid
Multicaulin
A diterpenoid that is phenanthrene substituted by a methoxy group at position 6, methyl groups at position 1 and 2 and an isopropyl group at position 7. A norabietane derivative, it is isolated from the roots of Salvia multicaulis and exhibits antitubercular activity.
1-(3,4-dihydro-5-hydroxy-7-methoxy-2,2-dimethyl-2 h -1-benzopyran-8-yl)-2-methyl-1-propanone
1-O-acetylbritannilactone|1-O-acetylbritannilatone
Isobutyric acid 2-(2-acetoxy-1-methylethyl)-5-methylphenyl ester
3,7-Dihydro-3,7-dimethyl-6-[(5-oxohexyl)oxy]-2H-purin-2-one
2,4,6-Trihydroxy-2-methylbutyrophenon-4-O-3,3-dimethylallylether
(1alphaR,3R,4R,4alphaR,8alphaR,9alphaS)-3-methoxy-4,4alpha,6-trimethyl-1alpha,2,3,4,4alphaR,8alpha,9-octahydro-7H-oxirene[8,8alpha]naphtho[2,3beta]furan-7-one|daphnelnoid A
5alpha-Hydroxy-2alpha-methoxy-1(10), 3-guaiadien-12, 6alpha-olide|5alpha-hydroxy-2alpha-methoxy-11alphaH-guaia-1(10),3-dien-12,6alpha-olide
14-methyl hydrogen 12-hydroxydrim-8-ene-11,14-diate 11,12-lactone|polygonumate
(E )-7-(2-hydroxy-4-(hydroxymethyl)phenyl)-2-methyloct-6-enoic acid
(+)-7-dehydro-BFA|13-oxobrefeldin|7-dehydrobrefeldin A|7-Ketobrefeldin|7-oxo-brefeldin-A|7-oxobrefeldin A|TX-1852
(2R)-1-[2,6-dimethoxy-4-(prop-2-enyl)phenoxy]-3-methylbut-3-en-2-ol|lenisin B
7-Methyl-13-phenyltrideca-4,6,8,10,12-pentaen-3-on|Asperyellon
3-Methyl-2-butenoic acid 2-(1-methyl-1-methoxy-2-hydroxyethyl)-5-methylphenyl ester
6-Oxo-8alpha-methoxyepieremophilenolid|6-oxoeremophilenolide|8alpha-methoxy-6-oxoeremophil-7(11)-en-12,8-olide
11-O-(2-Pyrrolecarbonyl)-4-Hydroxyepilupinine
C15H22N2O3 (278.16303419999997)
2-(4-Methoxyphenyl)-3-methyl-5-(2-propenyl)benzofuran
8-methyl-13-phenyltrideca-4,6,8,10,12-pentaen-3-one
(4aR,6S,8aR,9aS)-6-hydroxyfurodysinin-O-methyl lactone
2,2-Dimethyl-5,7-dimethoxy-8-(1-methoxyethyl)-2H-1-benzopyran
(1S,4aS,8R,8aR)-4a,5,6,7,8,8a-hexahydro-8-hydroxy-5,5,8a-trimethylspiro[furan-2(5H),1(2H)-naphthalene]-35(4H)-dione|(1R,5S,9S,10R)-1beta-hydroxy-7-oxo-14-nor-13,14-secopodocarp-11-en-13,9a-olactone|cryptomelactone A
4-O-(2-Pyrrolecarbonyl)-4-Hydroxyepilupinine
C15H22N2O3 (278.16303419999997)
2alpha-methoxy-6-oxogermacra-1(10),7(11)-dien-8,12-olide|5,6,7,8,11,11a-hexahydro-8-methoxy-3,6,10-trimethylcyclodeca[b]furan-2,4-dione
(1S,4aS,6S,8aS)-4a,5,6,7,8,8a-hexahydro-6-hydroxy-5,5,8a-trimethylspiro[furan-2(5H),1(2H)-naphthalene]-35(4H)-dione|(3S,5S,9S,10S)-3beta-hydroxy-7-oxo-14-nor-13,14-secopodocarp-11-en-13,9a-olactone|cryptomelactone B
ButylIsobutylPhthalate
Butyl isobutyl phthalate is a natural product found in Houttuynia cordata, Cryptotaenia canadensis, and Perilla frutescens var. hirtella with data available. Butyl isobutyl phthalate is isolated from the rhizoid of Laminaria japonica. Butyl isobutyl phthalate is a non-competitive α-glucosidase inhibitor with an IC50 value of 38 μM. Butyl isobutyl phthalate shows a hypoglycemic effect and has the potential for diabetes treatment[1]. Butyl isobutyl phthalate is isolated from the rhizoid of Laminaria japonica. Butyl isobutyl phthalate is a non-competitive α-glucosidase inhibitor with an IC50 value of 38 μM. Butyl isobutyl phthalate shows a hypoglycemic effect and has the potential for diabetes treatment[1].
1,7-Diphenyl-5-hydroxy-4,6-hepten-3-one
1,7-Diphenyl-5-hydroxy-4,6-hepten-3-one is a natural product found in Alpinia hainanensis with data available.
Bz-Arg-OH
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.291 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.292 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.285 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.288
C16H22O4_(1R,2E,6S,10E,11aS,14aR)-1-Hydroxy-6-methyl-6,7,8,9,11a,12,14,14a-octahydro-4H-cyclopenta[f]oxacyclotridecine-4,13(1H)-dione
pentoxifylline
C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AD - Purine derivatives COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors D020011 - Protective Agents > D011837 - Radiation-Protective Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor D000975 - Antioxidants > D016166 - Free Radical Scavengers D020011 - Protective Agents > D000975 - Antioxidants Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
triprolidine
R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D018926 - Anti-Allergic Agents
Phenylalanylisoleucine (isomer of 1328)
C15H22N2O3 (278.16303419999997)
Annotation level-3
Phenylalanylisoleucine (isomer of 1329)
C15H22N2O3 (278.16303419999997)
Annotation level-2
Ile-phe
C15H22N2O3 (278.16303419999997)
A dipeptide formed from L-isoleucine and L-phenylalanine residues.
Leu-phe
C15H22N2O3 (278.16303419999997)
A dipeptide formed from L-leucine and L-phenylalanine residues. Leucyl-phenylalanine belongs to the class of organic compounds known as dipeptides.
Phe-ile
C15H22N2O3 (278.16303419999997)
A dipeptide formed from L-phenylalanine and L-isoleucine residues.
Pro-tyr
A dipeptide formed from L-proline and L-tyrosine residues.
tert-Butyl 7-nitro-3,4-dihydroisoquinoline-2(1H)-carboxylate
2-(2-(Ethylthiomethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C15H23BO2S (278.15117280000004)
1,2-Propanediol,2,2-dimethyl-1,3-propanediol,2,5-furandione polymer
tert-Butyl 3-(4-aminophenoxy)pyrrolidine-1-carboxylate
C15H22N2O3 (278.16303419999997)
tert-Butyl 4-guanidinopiperidine-1-carboxylate hydrochloride
[4-(4-METHOXY-PHENYL)-2,2-DIMETHYL-TETRAHYDRO-PYRAN-4-YL]-ACETIC ACID
2,2-Difluoro-3-[(2-methyl-1-oxo-2-propen-1-yl)oxy]pentanoic acid 1,1-dimethylethyl ester
methyl 4-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzoate
C15H22N2O3 (278.16303419999997)
2-(3-METHOXY-BENZYL)-3-OXO-HEXANOIC ACID ETHYL ESTER
5-(1-methylpiperidin-4-ylidene)chromeno[2,3-b]pyridine
tert-Butyl 4-(5-aminopyridin-2-yl)piperazine-1-carboxylate
(S)-1N-BOC-2-(S-1-METHYLPROPYL)PIPERAZINE-HCl
C13H27ClN2O2 (278.17609519999996)
tert-Butyl 7-nitro-3,4-dihydroquinoline-1(2H)-carboxylate
methyl 2-amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-3-carboxylate
2-methyl-3-nitro-N,N-dipropylbenzeneacetamide
C15H22N2O3 (278.16303419999997)
TERT-BUTYL (1-(METHYLSULFONYL)PIPERIDIN-4-YL)CARBAMATE
(S)-tert-Butyl 2-isobutylpiperazine-1-carboxylate hydrochloride
C13H27ClN2O2 (278.17609519999996)
4-(Pyridin-4-yloxy)-piperidine-1-carboxylic acid tert-butyl ester
C15H22N2O3 (278.16303419999997)
Propanedioic acid,2-[[(6-methyl-2-pyridinyl)amino]methylene]-, 1,3-diethyl ester
4-CarboxyMethyl-piperazine-1-carboxylic acid benzyl ester
1-(tetrahydro-2H-pyran-2-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
tert-butyl 4-(4-hydroxyphenyl)piperazine-1-carboxylate
C15H22N2O3 (278.16303419999997)
(R)-TERT-BUTYL 2-ISOBUTYLPIPERAZINE-1-CARBOXYLATE HYDROCHLORIDE
C13H27ClN2O2 (278.17609519999996)
4-(2-TERT-BUTOXYCARBONYLAMINO-2-IMINO-ETHYL)-BENZOIC ACID
4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-[2,4]BIPYRIDINYL-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C15H22N2O3 (278.16303419999997)
tert-butyl N-[(3R)-1-(5-aminopyridin-2-yl)pyrrolidin-3-yl]carbamate
(1-PYRIMIDIN-4-YL-PIPERIDIN-4-YL)-CARBAMIC ACID TERT-BUTYL ESTER
3-(4-HYDROXY-PHENYL)-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C15H22N2O3 (278.16303419999997)
1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazole-5-boronic acid pinacol ester
1-(Tetrahydro-2H-pyran-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
2-(4-(Ethylthiomethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C15H23BO2S (278.15117280000004)
Methyl 4-(N-(tert-butoxycarbonyl)carbaMiMidoyl)benzoate
5-(Benzyloxy)-2-(2,5-dimethyl-1H-pyrrol-1-yl)pyridine
Dicyclopentenyloxyethyl-2-methacrylate (mixture of isomers, stabilised)
[3-(TERT-BUTOXYCARBONYLAMINO-IMINO-METHYL)-PHENYL]-ACETIC ACID
tert-butyl6-nitro-3,4-dihydroisoquinoline-2(1H)-carboxylate
Carbamic acid, cyclohexyl-, (2-nitrophenyl)methyl ester (9CI)
1-benzyl-2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepin-5-ium,chloride
N-Methyl-2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
(R)-tert-butyl 3-tert-butylpiperazine-1-carboxylate hydrochloride
C13H27ClN2O2 (278.17609519999996)
tert-butyl 3-tert-butylpiperazine-1-carboxylate hydrochloride
C13H27ClN2O2 (278.17609519999996)
(S)-4-N-BOC-2-ISOBUTYL-PIPERAZINE-HCl
C13H27ClN2O2 (278.17609519999996)
1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
Amprolium
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
(R)-1-Benzyl 2-methyl piperazine-1,2-dicarboxylate
5-oxo-DL-proline, compound with 2,2,2-nitrilotriethanol (1:1)
5-tert-butyl-2-[2-(4-fluorophenoxy)ethyl]-4H-pyrazol-3-one
(4-((2-Morpholinoethyl)carbamoyl)phenyl)boronic acid
tert-butyl 2-[(4R,6S)-6-(chloromethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
6-amino-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methyl-3-Pyridinecarbonitrile
(S)-tert-butyl 1-(5-aminopyridin-2-yl)pyrrolidin-3-ylcarbamate
5-Boc-2-(dimethylamino)-5,6,7,8-tetrahydropyrido[3,2-d]pyrimidine
4-(3-{[tert-butyl(dimethyl)silyl]oxy}propyl)benzaldehyde
tert-butyl 7-(2-hydroxyethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxylate
C15H22N2O3 (278.16303419999997)
(3-Glycidoxypropyl)triethoxysilane
C12H26O5Si (278.15494259999997)
Propanedioicacid, 2-[[(5-methyl-2-pyridinyl)amino]methylene]-, 1,3-diethyl ester
1,2-Benzenedicarboxylicacid, 1-(1-methylheptyl) ester
4-[4-(cyclopentylamino)-2-methylpyrimidin-5-yl]benzonitrile
Keratin Sulfate Sodium Salt,from Bovine Cornea
C15H22N2O3 (278.16303419999997)
2-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
(2S,5R)-ethyl 5-(benzyloxyaMino)piperidine-2-carboxylate
C15H22N2O3 (278.16303419999997)
4-[4-(1,1-DiMethylethyl)phenyl]-2,3-dihydro-2-Methyl-1H-inden-1-one
3-(3-HYDROXY-PHENYL)-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C15H22N2O3 (278.16303419999997)
1,3,7-TRIMETHYL-8-PIPERAZIN-1-YL-3,7-DIHYDRO-PURINE-2,6-DIONE
(R)-4-N-Cbz-Piperazine-2-carboxylic acid methyl ester
6-(TERT-BUTOXYCARBONYL)-5,6,7,8-TETRAHYDRO-1,6-NAPHTHYRIDINE-2-CARBOXYLIC ACID
2-(Methoxycarbonylamino)pyridine-5-boronic acid pinacol este
3-Methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
Methyl 3-hydroxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
1-(Tetrahydro-2H-pyran-2-yl)-1H-imidazole-5-boronic acid pinacol ester
7-[(tert-butoxy)carbonyl]-5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylic acid
tert-Butyl [1-(5-aminopyridin-2-yl)pyrrolidin-3-yl]carbamate
1-(2-HYDROXY-PHENYL)-PIPERAZINE-4-CARBOXYLIC ACID TERT-BUTYL ESTER
C15H22N2O3 (278.16303419999997)
[1-(2-hydroxymethyl-phenyl)-azetidin-3-yl]-carbamic acid tert-butyl ester
C15H22N2O3 (278.16303419999997)
TERT-BUTYL 5-NITRO-3,4-DIHYDROISOQUINOLINE-2(1H)-CARBOXYLATE
Propanedioic acid,2-[[(4-methyl-2-pyridinyl)amino]methylene]-, 1,3-diethyl ester
tert-butyl N-[2-(5-fluoro-1H-indol-3-yl)ethyl]carbamate
tert-butyl 4-(3-hydroxyphenyl)piperazine-1-carboxylate
C15H22N2O3 (278.16303419999997)
tert-Butyl 4-(6-aminopyridin-3-yl)piperazine-1-carboxylate
3-Nitro-4-(Cyclohexylamino) Benzoic Acid Methyl Ester
tert-butyl (2R)-2-butylpiperazine-1-carboxylate,hydrochloride
C13H27ClN2O2 (278.17609519999996)
(R)-4-N-BOC-2-ISOBUTYLPIPERAZINE-HCl
C13H27ClN2O2 (278.17609519999996)
tert-butyl (2S)-2-butylpiperazine-1-carboxylate,hydrochloride
C13H27ClN2O2 (278.17609519999996)
tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate,hydrochloride
C13H27ClN2O2 (278.17609519999996)
4-(3-endo-Hydroxy-8-azabicyclo(3.2.1)oct-8-yl)naphthalene-1-carbonitrile
3-Methyl-1-(2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl)butan-1-one
Pyridine, 2-[1-(4-methylphenyl)-3-(1-pyrrolidinyl)-1-propenyl]-, (E)-
1,9-Dihydro-9-(1-(1-hydroxyethyl)heptyl)-6H-purin-6-one
Asperenone
An enone that is (4E,6E,8E,10E,12E)-8-methyl-13-phenyltrideca-4,6,8,10,12-pentaene in which the two methylene hydrogens at position 3 have been replaced by an oxo group. Originally isolated from Aspergillus niger.
1-(Diethylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
(1S,2S,3E,7R,11E,13R)-2-Hydroxy-7-methyl 6-oxabicyclo[11.3.0]hexadecane-3,11-diene-5,15-dione
5-Imino-1-phenyl-4-(phenylhydrazinylidene)-3-pyrazolamine
2-(1H-benzimidazol-2-ylmethoxymethyl)-1H-benzimidazole
N-[4-(4-morpholinyl)phenyl]carbamic acid butyl ester
C15H22N2O3 (278.16303419999997)
N-(4-methylphenyl)-6-(1-pyrazolyl)-3-pyridinecarboxamide
(2,6,6-Trimethylcyclohex-1-enylmethanesulfonyl)benzene
(4r)-4-(3-Butoxy-4-Methoxybenzyl)imidazolidin-2-One
C15H22N2O3 (278.16303419999997)
[(4R)-2,2-Dimethyl-1,3-dioxolan-4-YL]methyl hydrogen hex-5-enylphosphonate
[(4S)-2,2-Dimethyl-1,3-dioxolan-4-YL]methyl hydrogen hex-5-enylphosphonate
Proquazone
M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids 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 D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors
Elaol
P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03B - Insecticides and repellents D010968 - Plasticizers
(4E,6E)-1-(4-hydroxyphenyl)-7-phenylhepta-4,6-dien-3-one
2-Benzamido-5-(diaminomethylideneazaniumyl)pentanoate
2-[[(2R)-2-amino-3-(4-hydroxy-2-methylpentan-2-yl)sulfanylpropanoyl]amino]acetic acid
(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)methyl-[(4S,5R)-4,5-dihydroxycyclopent-2-en-1-yl]azanium
C12H16N5O3+ (278.12530860000004)
(S)-1-Methylhexyl Caffeate
An alkyl caffeate ester obtained by the formal condensation of trans-caffeic acid with heptan-2-ol. It has been isolated from the leaves of Piper sanguineispicum.
7-methyl-2-(2-phenylethyl)-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
1-(1-Methylethyl)-3-(Pyridin-3-Ylethynyl)-1h-Pyrazolo[3,4-D]pyrimidin-4-Amine
Queuine(1+)
C12H16N5O3+ (278.12530860000004)
An organic cation that is the conjugate acid of queuine, obtained by protonation of the secondary amino group; major species at pH 7.3.
2-(4-Methoxyphenyl)-1-(2-methylprop-2-enyl)benzimidazole
2-Propyl-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
6-tert-butyl-3-cyclohexyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-Methyl-2-methylene-1,5-diphenylpentane-1,5-dione
1-(2-Methyl-6-propan-2-ylphenyl)-5-phenyltetrazole
4,8-dimethyl-1-(phenylmethyl)-3H-1,5-benzodiazepin-2-one
8-methoxy-2-methyl-N-(2-methylphenyl)-4-quinolinamine
7-Methyl-3-(phenylhydrazo)-1,5-benzodiazepin-2-one
N-[(E)-furan-2-ylmethylideneamino]-4-methyl-6-phenylpyrimidin-2-amine
N,N-dimethyl-2-(5,6,7-trimethoxy-1H-indol-3-yl)ethanamine
C15H22N2O3 (278.16303419999997)
6-(Diisopropylamino)-6-(thiophen-3-yl)hexanenitrile
N-[(2-methoxy-1-naphthalenyl)methyl]-1-(2-pyridinyl)methanamine
2-Amino-4-(((3-carbamoyl-1,2,4-oxadiazol-5-yl)methyl)amino)-6-isopropylpyrimidin-1-ium
(3R)-6-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxyhexanoic acid
(3R,5R)-5-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxyhexanoic acid
(1S,12S,13R,14R,15E)-15-ethylidene-13-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene
N-butyl-N(2)-[(R)-2-hydroxy-2-phenylacetyl]-L-alaninamide
C15H22N2O3 (278.16303419999997)
N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2,4-dimethylbenzamide
2-(4-Hydroxy-3-methylbut-2-en-1-yl)-4-(3-methylbut-2-en-1-yl)benzene-1,3,5-triol
2-[[3-Methyl-3-(4-methylpent-3-enyl)oxiran-2-yl]methyl]benzene-1,3,5-triol
2-[(2E,6E)-8-hydroxy-3,7-dimethylocta-2,6-dienyl]benzene-1,3,5-triol
(2S)-2-amino-6-[[(3R,4R)-3,4,5-trihydroxy-2-oxopentyl]amino]hexanoic acid
1-(2-(2-Methyl-5-pyridyl)ethyl)-2,3,5-trimethylindole
5-Acetoxy-1-(2,6-dimetoxyphenyl)-3-methyl-2-pentene
2-(2-Acetoxyethyl)-3,4-dihydro2,5,7-trimethyl-2H-1-benzopyran-6-ol
[3-(3-Acetyloxy-2-hydroxypropoxy)-1-carboxypropyl]-trimethylazanium
C12H24NO6+ (278.16035439999996)
UNII:FU2EWB60RT
Phthalic acid mono-2-ethylhexyl ester (MEHP) is a major bioactive metabolite of diethylhexyl phthalate (DEHP), which inhibits the 17, 20 lyase activity of CYP17[1]. Phthalic acid mono-2-ethylhexyl ester (MEHP) is a major bioactive metabolite of diethylhexyl phthalate (DEHP), which inhibits the 17, 20 lyase activity of CYP17[1].
Pantetheine
An amide obtained by formal condensation of the carboxy group of pantothenic acid and the amino group of cysteamine. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Cuprizone
D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors D064449 - Sequestering Agents > D002614 - Chelating Agents
RO 20-1724
C15H22N2O3 (278.16303419999997)
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors
Monooctyl phthalate
A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of octanol.
phe-leu
C15H22N2O3 (278.16303419999997)
A dipeptide obtained by formal condensation of the carboxy group of L-phenylalanine with the amino group of L-leucine.
Phe-Leu zwitterion
C15H22N2O3 (278.16303419999997)
A dipeptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Phe-Leu.
1-(2-Amino-3-phenylpropanoyl)-4-hydroxypyrrolidine-2-carboxylic acid
DREADD agonist 21
DREADD agonist 21 is a potent human muscarinic acetylcholine M3 receptors (hM3Dq) agonist (EC50=1.7 nM)[1].