Exact Mass: 260.13471200000004
Exact Mass Matches: 260.13471200000004
Found 500 metabolites which its exact mass value is equals to given mass value 260.13471200000004,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
LDR cpd
Linderane is a member of dioxanes. Linderane is a natural product found in Cryptocarya densiflora, Neolitsea villosa, and other organisms with data available. Linderane, isolated from the root of Lindera aggregata, is an irreversible inhibitor cytochrome P450 2C9 (CYP2C9). Linderane has the potential to relieve pain and cramp[1]. Linderane, isolated from the root of Lindera aggregata, is an irreversible inhibitor cytochrome P450 2C9 (CYP2C9). Linderane has the potential to relieve pain and cramp[1].
Hemigossypol
Hemigossypol is a sesquiterpenoid. Hemigossypol is a natural product found in Sida rhombifolia, Hibiscus trionum, and other organisms with data available.
Cyclo(Leu-Phe)
Cyclo(leu-phe), also known as cyclo(Phe-leu) or cFL, is classified as an alpha amino acid or an Alpha amino acid derivative. Alpha amino acids are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof. Cyclo(leu-phe) is considered to be a practically insoluble (in water) and a moderately acidic compound. Cyclo(leu-phe) can be found in feces.
Maculosin
A homodetic cyclic peptide that is a dipeptide composed of L-proline and L-tyrosine joined by peptide linkages. Maculosin is a host-specific phytotoxin for spotted knapweed from Alternaria alternata. Maculosin is a quorum-sensing molecule involved in cell-cell communication by Pseudomonas aeruginosa. Maculosin also acts as a signaling molecule regulating virulence gene expression in Lactobacillus reuteri. Maculosin shows antioxidant, anti-cancer and non-toxicity properties. Maculosin shows cytotoxic activity against the human liver cancer cell lines, with an IC50 of 48.90 μg/mL[1][2][3]. Maculosin is a host-specific phytotoxin for spotted knapweed from Alternaria alternata. Maculosin is a quorum-sensing molecule involved in cell-cell communication by Pseudomonas aeruginosa. Maculosin also acts as a signaling molecule regulating virulence gene expression in Lactobacillus reuteri. Maculosin shows antioxidant, anti-cancer and non-toxicity properties. Maculosin shows cytotoxic activity against the human liver cancer cell lines, with an IC50 of 48.90 μg/mL[1][2][3].
10-Hydroxy-3-methoxy-1,3,5,7-cadinatetraen-9-one
10-Hydroxy-3-methoxy-1,3,5,7-cadinatetraen-9-one is found in fats and oils. 10-Hydroxy-3-methoxy-1,3,5,7-cadinatetraen-9-one is from Gossypium hirsutum (cotton). From Gossypium hirsutum (cotton). 10-Hydroxy-3-methoxy-1,3,5,7-cadinatetraen-9-one is found in fats and oils.
Cyperine
Cyperine is found in root vegetables. Cyperine is a metabolite of a fungal pathogen of Cyperus rotundus (nutgrass). Metabolite of a fungal pathogen of Cyperus rotundus (nutgrass). Cyperine is found in root vegetables.
Baptifoline
Baptifoline is found in coffee and coffee products. Baptifoline is an alkaloid from Caulophyllum thalictroides (blue cohosh). Alkaloid from Caulophyllum thalictroides (blue cohosh). Baptifoline is found in coffee and coffee products.
Methaphenilene
C15H20N2S (260.13471200000004)
C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist
N,N'-Diphenyl-p-phenylenediamine
D020011 - Protective Agents > D000975 - Antioxidants
Homobaldrinal
Homobaldrinal is a fatty acid ester. Homobaldrinal is a natural product found in Valeriana officinalis, Valeriana edulis, and other organisms with data available.
1-(4-Hydroxy-2-methylpyrimid-5-ylmethyl)-3-(2-hydroxyethyl)-2-methylpyridinium
Apigravin
Isolated from Apium graveolens. Apigravin is found in wild celery and green vegetables. Apigravin is found in green vegetables. Apigravin is isolated from Apium graveolen Apigravin is a hydroxycoumarin.
Gamma-glutamyl-leucine
gamma-Glutamylleucine is a dipeptide composed of gamma-glutamate and leucine, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. gamma-Glutamylleucine 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. gamma-Glutamylleucine is a biomarker for the consumption of whey protein. It is found in urine (PMID: 3782411). Gamma-glutamylleucine, also known as gamma-glutamyl-leucine, (d,l)-isomer or L-gamma-glu-L-leu, 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. Gamma-glutamylleucine is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Gamma-glutamylleucine can be found in soft-necked garlic, which makes gamma-glutamylleucine a potential biomarker for the consumption of this food product. Gamma-glutamylleucine can be found primarily in blood and feces. H-γ-Glu-Leu-OH is a dipeptide consisting of γ-glutamic acid and leucine, terminated by a hydroxyl group[1].
7,8-Dihydroyangonin
7,8-Dihydroyangonin is found in beverages. 7,8-Dihydroyangonin is a constituent of Piper methysticum (kava). FDA advises against use of kava in food due to potential risk of severe liver damage (2002). Constituent of Piper methysticum (kava). FDA advises against use of kava in food due to potential risk of severe liver damage (2002). 7,8-Dihydroyangonin is found in beverages.
Isoleucyl-Glutamate
Isoleucyl-Glutamate is a dipeptide composed of isoleucine and glutamate. 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.
3-(1,1-Dimethylallyl)scopoletin
3-(1,1-Dimethylallyl)scopoletin is found in herbs and spices. 3-(1,1-Dimethylallyl)scopoletin is a constituent of Ruta graveolens (rue). Constituent of Ruta graveolens (rue). 3-(1,1-Dimethylallyl)scopoletin is found in herbs and spices.
(S)-Auraptenol
(s)-auraptenol belongs to coumarins and derivatives class of compounds. Those are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one) (s)-auraptenol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (s)-auraptenol can be found in citrus, which makes (s)-auraptenol a potential biomarker for the consumption of this food product. (S)-Auraptenol is found in citrus. (S)-Auraptenol is a constituent of Seville bitter orange (Citrus aurantium ssp. amara) oil
Citrusal
Citrusal is found in citrus. Citrusal is a constituent of grapefruit peel oil (Citrus paradisi)
(E)-Suberenol
Isolated from Limonia acidissima (wood apple) and Citrus nobilis (king orange). (E)-Suberenol is found in many foods, some of which are beverages, sweet orange, citrus, and fruits. (E)-Suberenol is found in beverages. (E)-Suberenol is isolated from Limonia acidissima (wood apple) and Citrus nobilis (king orange
(R)-Meranzin
(r)-meranzin belongs to coumarins and derivatives class of compounds. Those are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one) (r)-meranzin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). (r)-meranzin can be found in citrus, which makes (r)-meranzin a potential biomarker for the consumption of this food product. (R)-Meranzin is found in citrus. (R)-Meranzin is a constituent of orange peel oil
7-Methoxy-5-prenyloxycoumarin
7-Methoxy-5-prenyloxycoumarin is found in citrus. 7-Methoxy-5-prenyloxycoumarin is isolated from lemon oil (Citrus limon). Isolated from lemon oil (Citrus limon). 5-Prenyloxy-7-methoxycoumarin is found in citrus.
Glutamylleucine
Glutamylleucine is a dipeptide composed of glutamate and leucine, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Glutamylleucine 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.
gamma-Glutamylisoleucine
gamma-Glutamylisoleucine is a dipeptide composed of gamma-glutamate and isoleucine, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. gamma-Glutamylisoleucine 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. It is found in urine (PMID: 3782411).
Dihydrowyerone
Dihydrowyerone is found in pulses. Dihydrowyerone is a minor constituent of broad bean Vicia faba infected with Botrytis specie Minor constituent of broad bean Vicia faba infected with Botrytis subspecies Dihydrowyerone is found in pulses.
5,6-Dihydroyangonin
5,6-Dihydroyangonin is found in beverages. 5,6-Dihydroyangonin is a constituent of Piper methysticum (kava). FDA advises against use of kava in food due to potential risk of severe liver damage (2002). Constituent of Piper methysticum (kava). FDA advises against use of kava in food due to potential risk of severe liver damage (2002). 5,6-Dihydroyangonin is found in beverages.
4-[2-(3-hydroxy-5-methoxyphenyl)ethyl]benzene-1,2-diol
3-(1,1-dimethyl-allyl)-6-hydroxy-7-methoxy-coumarin
Anhydromarasmone
Anhydromarasmone is found in mushrooms. Anhydromarasmone is a constituent of Marasmius oreades (fairy ring mushroom) Constituent of Marasmius oreades (fairy ring mushroom). Anhydromarasmone is found in mushrooms.
7-Hydroxy-5-isopropyl-2-methoxy-3-methyl-1,4-naphthoquinone
7-Hydroxy-5-isopropyl-2-methoxy-3-methyl-1,4-naphthoquinone is found in nuts. 7-Hydroxy-5-isopropyl-2-methoxy-3-methyl-1,4-naphthoquinone is isolated from infected trunks of Pachira aquatica (Malabar chestnut). Isolated from infected trunks of Pachira aquatica (Malabar chestnut). 7-Hydroxy-5-isopropyl-2-methoxy-3-methyl-1,4-naphthoquinone is found in nuts.
Wyerol
Wyerol is found in pulses. Wyerol is isolated from seedlings of broad bean Vicia faba infected with Botrytis species. Isolated from seedlings of broad bean Vicia faba infected with Botrytis subspecies Wyerol is found in pulses.
Glutamylisoleucine
Glutamylisoleucine is a dipeptide composed of glutamate and isoleucine, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Glutamylisoleucine 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.
Pergillin
Production by Aspergillus ustus growing on seeds of Pisum sativum (pea). Pergillin is found in pulses and common pea. Pergillin is found in pulses. Pergillin is produced by Aspergillus ustus growing on seeds of Pisum sativum (pea).
Celerin
Constituent of seeds of Apium graveolens (celery). Celerin is found in wild celery and green vegetables. Celerin is found in green vegetables. Celerin is a constituent of seeds of Apium graveolens (celery)
Kanzonol Q
Kanzonol Q is found in herbs and spices. Kanzonol Q is a constituent of the roots of Glycyrrhiza uralensis (Chinese licorice). Constituent of the roots of Glycyrrhiza uralensis (Chinese licorice). Kanzonol Q is found in herbs and spices.
Asparaginyl-Lysine
C10H20N4O4 (260.14844800000003)
Asparaginyl-Lysine is a dipeptide composed of asparagine and lysine. 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.
Lysylasparagine
C10H20N4O4 (260.14844800000003)
Lysylasparagine is a dipeptide composed of lysine and asparagine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Glutaminylasparagine
Glutaminylasparagine is a dipeptide composed of glutamine and asparagine. 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.
Asparaginylglutamine
Asparaginylglutamine is a dipeptide composed of asparagine and glutamine. 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.
Asparaginyl-Gamma-glutamate
Asparaginyl-Gamma-glutamate is a dipeptide composed of asparagine and gamma-glutamate. 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.
Leucyl-Glutamate
Leucyl-Glutamate is a dipeptide composed of leucine and glutamate. 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.
Glycerol tripropanoate
Glycerol tripropanoate is a flavouring ingredient. Flavouring ingredient
Diaveridine
C13H16N4O2 (260.12731959999996)
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
Fenspiride
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents R - Respiratory system > R03 - Drugs for obstructive airway diseases
8-Deoxylactucin
8-deoxylactucin is a member of the class of compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. 8-deoxylactucin is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 8-deoxylactucin can be found in chicory, which makes 8-deoxylactucin a potential biomarker for the consumption of this food product.
Isomerazin
Isomeranzin is a natural product found in Prangos tschimganica, Clausena anisata, and other organisms with data available.
[3aS-(3aalpha,9aalpha,9bbeta)]-3,3a,4,5,9a,9b-Hexahydro-9a-hydroxy-6,9-dimethyl-3-methylene-azuleno[4,5-b]furan-2,7-dione
3-(3-Hydroxy-3-methyl-trans-but-1-enyl)-7-methoxycoumarin
Pseudoneolinderane
A natural product found in Neolitsea daibuensis. 5H-7,4-Methenofuro(3,2-c)oxireno(f)oxacycloundecin-5-one,1a,2,3,7,11,11a-hexahydro-8,11a-dimethyl-, (1aS,7R,11aS)- is a natural product found in Neolitsea umbrosa, Cinnamomum iners, and other organisms with data available.
2alpha-Methoxy-3,10(14),11(13)-guaiatrien-12,6alpha-olide
1,4-Dihydroxy-2-(3,7-dimethyl-1-oxo-octa-2-E-6-dienyl)benzene
(E,E)-5-(2,6-Dimethyl-1,5,7-octatrienyl)-3-furancarboxylic acid methyl ester
6-(2-Hydroxy-3-methyl-3-butenyl)-7-methoxycoumarin
9-Oxo-bis-abola-1,3,5,7E-tetraen-15-oic acid methyl ester
1beta,10beta-Epoxyfuranoeremophil-1(10)-ene-6,9-dione
5,6,9,10-Tetradehydro-1,4:3,14-diepoxy-4-hydroxy-4,5-secofuranoeremophilane
(E,Z)-5-(2,6-Dimethyl-1,5,7-octatrienyl)-3-furancarboxylic acid methyl ester
fenspiride
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents R - Respiratory system > R03 - Drugs for obstructive airway diseases
DIAVERIDINE
C13H16N4O2 (260.12731959999996)
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent CONFIDENCE standard compound; EAWAG_UCHEM_ID 3645 CONFIDENCE standard compound; INTERNAL_ID 1085
N-Nitrosofenfluramine
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3472 CONFIDENCE standard compound; INTERNAL_ID 2116
Nadoxolol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist
1-(1-hydroxybutyl)-1,3,4,5,6,7-hexahydro-2-benzofuran-4,5,6,7-tetrol
(E,E)-1-(3,4-dihydroxyphenyl)deca-1,3-dien-5-one|(E,E)-1-(3,4-Dihydroxyphenyl)-1,3-decadien-5-one
(+/-)-elacomine|(+/-)-isoelacomine|(+/-)-isoelocamine|6-Hydroxy-2-(2-methylpropyl)spiro[3H-indole-3,3-pyrrolidin]-2(1H)-one
(6E,12E)-3-hydroxytetradeca-6,12-dien-8,10-diyn-1-yl acetate|1-Ac-6,12-Tetradecadiene-8,10-diyne-1,3-diol
2,3-dihydro-5,7-dimethoxyspiro[cyclohexane-1,1-[1H]inden]-4-one|7-methoxycannabispirone
2,6-Dideoyx-3-C-methuyl-3-O-methyl-ribo-hexose,9CI-Di-Ac
alpha-L-Sorbofuranose, 2,3:4,6-bis-o-(1-methylethylidene)-
3-methoxy-10-methylenefurano-germacra-1-en-6-one|rel-3R-methoxy-4S-furanogermacra-1E,10(15)-dien-6-one
Me glycoside,2,3-O-isopropylidene,isopropyl ester-beta-D-Furanose-Riburonic acid
7-isopropyl-5-methoxy-2,2,4-trimethyl-1H-indene-1,3(2H)-dione
(1RS,2RS,4SR)-1-((R,E)-3,4-dihydroxybut-1-enyl)-2,6,6-trimethylcyclohexane-1,2,4-triol|euphorheliosin A
2-(acetyloxy)-5-ethyl-2,3-dimethylhexanedioic acid
methyl (1aS,7aS,7bS)-1a,2,3,5,7a,7b-hexahydro-1,4,7-trimethyl-5-oxo-1H-cycloprop[e]azulene-1-carboxylate
1-Ac-4,6-Tetradecadiene-8,10-diyne-1,12-diol|Tetradeca-4,6-dien-8,10-diin-1,12-diol-1-acetat
6,7,8,9-tetrahydro-3-methoxymethyl-5,9-dimethyl-8-hydroxy-nafto<1,2b>furan|6,7,8,9-tetrahydro-3-methoxymethyl-5,9-dimethyl-8-hydroxy-nafto[1,2b]furan|Citreobenzofuran C
(+)-(1R*, 3S*, 5S*, 6S*, 7R*, 7aS*)-5-acetamidomethyl-3-hydroxymethyl-1,6,7-trihydroxypyrrolizidine|pochonicine
3,6,9-Trimethyl-7-methoxy-7,8,9,9a-tetrahydroazuleno[4,5-b]furan-4(6aH)-one
1-((R)-6-hydroxy-2-methyl-2H-chromen-2-yl)-4-methylpentan-2-one
hexahydrospiro[1,3-benzodioxole-2,1-cyclohexane]-4,5,6,7-tetrol
2,2,2,2-tetramethylspiro[1,3-dioxolane-4,6-3a,4,7,7a-tetrahydro-[1,3]dioxolo[4,5-c]pyran]-7-ol
(2R,4R,6R)-4-hydroxy-2-methoxy-6-(1-phenyl-2-propenyl)-cyclohexanone
(7S)-(14at)-1,2,3,4,7,9,10,11,14,14a-Decahydro-7r,14c-methano-dipyrido[1,2-a;1,2-e][1,5]diazocin-6,13-dion|(7S)-(14at)-1,2,3,4,7,9,10,11,14,14a-decahydro-7r,14c-methano-dipyrido[1,2-a;1,2-e][1,5]diazocine-6,13-dione
3,4-Dihydro-2,2-dimethyl-7-(3-methyl-2-butenyl)-2H-1-benzopyran-5,8-dione
2-Oxo-3-(1-methoxycarbonyl-ethyl)-5.8a beta-dimethyl-6.8-cyclo-1.2.6alpha.7.8alpha.8a-hexahydro-naphthalin|2-Oxo-3-<1-methoxycarbonyl-ethyl>-5.8a beta-dimethyl-6.8-cyclo-1.2.6alpha.7.8alpha.8a-hexahydro-naphthalin
Cardiogenol C
C13H16N4O2 (260.12731959999996)
rel-3R-Methoxy-4S-furanogermacra-1E,10(15)-dien-6-one
Baptifoline
Unii-27F71M186X is a natural product found in Thermopsis chinensis, Thermopsis lanceolata, and other organisms with data available. See also: Caulophyllum thalictroides Root (part of).
gamma-Glutamylleucine
H-γ-Glu-Leu-OH is a dipeptide consisting of γ-glutamic acid and leucine, terminated by a hydroxyl group[1].
2-(5-Hydroxymethyl-8-methyl-3-oxa-bicyclo[3.3.1]non-7-en-2-yl)-phenol
H-Glu(Leu-OH)-OH
H-γ-Glu-Leu-OH is a dipeptide consisting of γ-glutamic acid and leucine, terminated by a hydroxyl group[1].
C14H16N2O3_Pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-3-[(4-hydroxyphenyl)methyl]
C16H20O3_2-Naphthaleneacetic acid, 1,2,3,7,8,8a-hexahydro-8,8a-dimethyl-alpha-methylene-7-oxo-, methyl ester, (2R,8R,8aR)
Imolamine
C - Cardiovascular system > C01 - Cardiac therapy > C01D - Vasodilators used in cardiac diseases C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
Cyclo(phenylalanylleucyl), (3S,6S)-form
Origin: Microbe; SubCategory_DNP: Peptides, Cyclic peptides, Piperazines
2-(7-hydroxyoctyl)pentanedioic acid [IIN-based on: CCMSLIB00000846675]
2-(7-hydroxyoctyl)pentanedioic acid [IIN-based: Match]
gamma-Glu-leu
A glutamyl-L-amino acid obtained by formal condensation of the gamma-carboxy group of glutamic acid with the amino group of leucine. H-γ-Glu-Leu-OH is a dipeptide consisting of γ-glutamic acid and leucine, terminated by a hydroxyl group[1].
Asn-GLN
A dipeptide composed of L-asparagine and L-glutamine joined by a peptide linkage.
Tripropionin
A triglyceride obtained by formal acylation of the three hydroxy groups of glycerol by propionic acid.
(S)-6-AMINO-3-((TERT-BUTOXYCARBONYL)AMINO)-6-OXOHEXANOIC ACID
ETHYL 4-(5-ISOPROPYL-1,2,4-OXADIAZOL-3-YL)BENZOATE
a-Methyl-4-[(2-oxocyclohexyl)methyl]- benzeneacetic acid
methyl 4-(4-methylpiperazin-1-yl)cubane-1-carboxylate
3-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanal
(S)-TERT-BUTYL (1-CYANO-3-PHENYLPROPAN-2-YL)CARBAMATE
tert-Butyl 3-formyl-5-methyl-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
CIS-2-(3,4-DIMETHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
3-TERT-BUTYL-1-(4-NITROPHENYL)-1H-PYRAZOL-5-AMINE
C13H16N4O2 (260.12731959999996)
4-ALLYL-5-[4-(DIMETHYLAMINO)PHENYL]-4H-1,2,4-TRIAZOLE-3-THIOL
(2R,5S)-5-AMINO-8-GUANIDINO-4-OXO-2-P-HYDROXYPHENYLMETHYLOCTANOICACIDSULFATE
5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazol-2-amine
2-METHOXY-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)NICOTINONITRILE
Trans-2-(3-methoxyphenyl)vinylboronic acid pinacol ester
1H-Azepine-1-carboxamide,N-(3-acetylphenyl)hexahydro-(9CI)
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2yl)benzo[d]oxazol-2-amine
5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE
ethyl 3-(4-methoxyphenyl)-1-methyl-1h-pyrazole-5-carboxylate
1-Benzyl-3-Methylimidazolium Tetrafluoroborate
C11H13BF4N2 (260.11078560000004)
4-Methoxy-trans-beta-styrylboronic acid pinacol ester
3H-1,2,4-Triazole-3-thione,4-cyclohexyl-2,4-dihydro-5-(4-pyridinyl)-
(1R,2S,5R)-2-ISOPROPYL-5-METHYLCYCLOHEXYL 4-CHLOROBUTANOATE
5-AMINO-1-BENZYL-1,2,3,6-TETRAHYDRO-PYRIDINE-4-CARBOXYLIC ACID ETHYL ESTER
tert-butyl 2-benzyl-2,7-diazaspiro[3.5]nonane-7-carboxylate
(1R,2S)-2-(4-ethylbenzoyl)cyclohexane-1-carboxylic acid
CIS-2-(3,5-DIMETHYLBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID
ethyl 1-(4-methoxyphenyl)-5-methyl-1h-pyrazole-4-carboxylate
2-acetamido-3-(5-methyl-1H-indol-3-yl)propanoic acid
(2-P-TOLYL-IMIDAZO[1,2-A]PYRIDIN-3-YL)-ACETONITRILE
D-chiro-Inositol,1,2:5,6-bis-O-(1-methylethylidene)-
2-[(E)-2-(2-methoxyphenyl)ethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
tert-butyl N-(3-thiomorpholin-4-ylpropyl)carbamate
evronalsodium
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators
5-Pyrimidinecarboxylicacid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-phenyl-, ethyl ester
5,6-DIAMINO-2-(2-PROPOXYPHENYL)-4(1H)PYRIMIDINONE
C13H16N4O2 (260.12731959999996)
1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propan-1-one
ethyl (E)-2-cyano-3-(3-ethoxyanilino)prop-2-enoate
Carbamic acid, N-[1,2,5,6-tetrahydro-4-methyl-1-(phenylmethyl)-3-pyridinyl]-, methyl ester
2-(3-FORMYL-INDOL-1-YL)-N-(2-METHOXY-ETHYL)-ACETAMIDE
Ethyl 2-amino-5-(4-methoxyphenyl)-1H-pyrrole-3-carboxylate
BENZYL 3-OXO-2,6-DIAZABICYCLO[3.2.1]OCTANE-6-CARBOXYLATE
1H-Pyrrolo[2,3-b]pyridine-5-carboxaldehyde, 1-[(1,1-dimethylethyl)dimethylsilyl]-
4-(3-Trimethylsilanylethynyl-pyridin-2-yl)-morpholine
(2R,3R,4R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,4-dihydro-2H-pyran-3,4-diol
6,7-Diethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile
benzyl 3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate
2-(3-Cydopropoxy-phenyl)-4,4,5,5-tetramethy-[1,3,2]dioxaborolane
1-[2-(5-fluoro-1H-indol-3-yl)ethyl]piperidin-2-one
3-(morpholin-4-ylmethyl)-5-(trifluoromethyl)aniline
4-(3-Trifluoromethyl-phenyl)-heptan-4-ol
C14H19F3O (260.13879199999997)
ETHYL 4-((TERT-BUTYLDIMETHYLSILYL)OXY)-3-OXOBUTANOATE
Phetharbital
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators
Ethyl 5-(tert-butylthio)-2,2-dimethyl-4-oxopentanoate
benzyl 3,6-diazabicyclo[3.2.2]nonane-6-carboxylate
1-cyclohexyl-3-[3-(2-hydroxyethoxy)propyl]thiourea
1-(4-METHOXY-PHENYL)-5-METHYL-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
4-PHENYL-5-PIPERIDIN-1-YL-4H-1,2,4-TRIAZOLE-3-THIOL
8,8-dimethoxy-2-phenyl-3,5,6,7-tetrahydro-2H-imidazo[1,2-a]pyridine
5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H,2H,3H-pyrrolo[2,3-b]pyridin-2-one
tert-butyl 4-hydroxy-4-(nitromethyl)piperidine-1-carboxylate
2-(3,4-dihydro-2H-chromen-8-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
(4R-Cis)-6-Hydroxymethyl-2,2-Dimethyl-1,3-Dioxane-4-Acetic Acid 1,1-Dimethylethyl Ester
ethyl 3-(cyclopropylcarbonyl)-a,a-dimethylphenylacetate
6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)chroman
trimethoxy-[3-(7-oxabicyclo[4.1.0]heptan-4-yl)propyl]silane
Ethyl 1-(4-methoxybenzyl)-1H-pyrazole-4-carboxylate
N-Ethyl-N-3-[(3-dimethylamine-1-oxo-2-propene)phenyl]acetamide
4-(4-(trifluoroMethyl)phenyl)heptan-4-ol
C14H19F3O (260.13879199999997)
1,2:5,6-Bis-O-(1-methylethylidene)-beta-L-mannofuranose
4-Amino-hexahydro-cyclopenta[c]pyrrole-2-carboxylic acid tert-butyl ester hydrochloride
1,2:4,6-Bis-O-(1-methylethylidene)-alpha-D-fructofuranose
2,3:5,6-Bis-O-(1-methylethylidene)-alpha-L-mannofuranose
1,2:4,6-Bis-O-(1-methylethylidene)-beta-D-fructofuranose
1,2-Cyclobutanedicarboxylic acid, 3,3-diethoxy-, 1,2-diMethyl ester
(2,2,7,7-Tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4,5-d]pyran-5-yl)methanol
5-[(3,5-dimethoxyphenyl)methyl]pyrimidine-2,4-diamine
C13H16N4O2 (260.12731959999996)
4-(morpholin-4-ylmethyl)-3-(trifluoromethyl)aniline
(5-tert-butyl-isoxazol-3-yl)-carbamic acid phenyl ester, (5-tert-butylisoxazol-3-yl)carbamic acid phenyl ester
3,6-DIHYDRO-2H-[2,4]BIPYRIDINYL-1-CARBOXYLIC ACID TERT-BUTYL ESTER
ethyl 2-(4-methoxyphenyl)-5-methylpyrazole-3-carboxylate
3-(1-AMINO-ETHYL)-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
2,5-dimethyl-3,4-diphenyl-cyclopenta-2,4-dien-1-one
5,5-DIMETHYL-3-((3-NITROPHENYL)AMINO)CYCLOHEX-2-EN-1-ONE
4-(4-Fluorobenzyl)-3-methyl-5-((R)-pyrrolidin-2-yl)-4H-1,2,4-triazole
3-[(4-Hydroxyphenyl)methyl]-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
4-cyclohexyl-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
p-Mentha-4,8-diene-2-acetic acid, 5,9-epoxy-alpha-methylene-1-vinyl-, methyl ester
2-Pentenoic acid, 2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
4H-Pyrido[1,2-a]pyrimidine-3-propanoic acid, 6-methyl-4-oxo-, ethyl ester
4H-Pyrido[1,2-a]pyrimidine-3-acetic acid, 6,8-dimethyl-4-oxo-, ethyl ester
4-[(1S,2S,5S)-5-(Hydroxymethyl)-8-methyl-3-oxabicyclo[3.3.1]non-7-EN-2-YL]phenol
2-[(2-Amino-4-carboxybutanoyl)amino]-3-methylpentanoic acid
2-{1-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-2-methyl-1,2-dihydro-3-pyridinyl}ethanol
[3-Carboxy-2-(4-oxopentanoyloxy)propyl]-trimethylazanium
[(2S)-3-carboxy-2-[(E)-3-carboxyprop-2-enoyl]oxypropyl]-trimethylazanium
[3-Carboxy-2-(3-oxopentanoyloxy)propyl]-trimethylazanium
[5-(2-Furanyl)-3-isoxazolyl]-(4-methyl-1-piperidinyl)methanone
5,7-dimethyl-4-methylene-3-(4-methylphenyl)-1H-naphthalene
N-(4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)pentanamide
Biscognienyne B
A member of the class of epoxides that is (1R,6S)-7-oxabicyclo[4.1.0]hept-3-ene substituted by 3-methylbut-2-en-1-yl, hydroxy, 2-methylbut-1-en-3-yn-4-yl, and hydroxy groups at positions 1, 2R, 3 and 5R. It is a meroterpenoid natural product synthesized by the Ascomycota fungus Biscogniauxia sp.
N(6)-(glycylglycyl)-L-lysine
C10H20N4O4 (260.14844800000003)
An L-alpha-amino acid consisting of L-lysine, to the epsilon amino group of which is attached a glycylglycine dipeptide through an isopeptide bond.
3-[5-(4-Ethylphenyl)-2-tetrazolyl]propanoic acid methyl ester
C13H16N4O2 (260.12731959999996)
N-[(3-cyclopentylpropanoyl)oxy]benzenecarboximidamide
5-(4-methoxyphenyl)-N-propan-2-yl-3-isoxazolecarboxamide
N-(3-cyclohexen-1-ylmethylene)-2,4-dihydroxybenzohydrazide
3-(5-oxo-2-pyrrolidinyl)-N-[(1S)-1-phenylethyl]propanamide
N-butan-2-yl-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-2H-isoxazole-3-carboxamide
N-[(3,4-dihydroxyphenyl)methyl]-2-(4-hydroxyphenyl)ethan-1-aminium
C15H18NO3+ (260.12866180000003)
N(5)-hydroxy-N(5)-[(2E)-5-hydroxy-3-methylpent-2-enoyl]-L-ornithine
(3Z,6Z)-dodeca-3,6-dien-1-ylsulfamate
An organic sulfamate oxoanion that is the conjugate base of (3Z,6Z)-dodeca-3,6-dien-1-ylsulfamic acid. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.
3-[(2-Carboxylatopropanoyl)oxy]-4-(trimethylazaniumyl)butanoate
(3Z,6Z,9Z)-dodeca-3,6,9-trien-1-yl hydrogen sulfate
A sulfuric ester of (3Z,6Z,9Z)-dodeca-3,6,9-trien-1-ol.
2-(1-Hydroxy-4-methylpent-3-enyl)-2-methylchromen-8-ol
[3-carboxy-2-[(E)-3-carboxyprop-2-enoyl]oxypropyl]-trimethylazanium
[(2R)-3-carboxy-2-[(E)-3-carboxyprop-2-enoyl]oxypropyl]-trimethylazanium
2-[(5R)-5-(hydroxymethyl)-8-methyl-3-oxabicyclo[3.3.1]non-7-en-2-yl]phenol
7-Methoxy-2,3-dimethyl-6-(2-nitro-1-propenyl)indole
Baptifoline
1,4-Dianilinobenzene
D020011 - Protective Agents > D000975 - Antioxidants
drilodefensin 1
An arenesulfonic acid that is furan-3-sulfonic acid carrying hexyl and ethyl substituents at positions 2 and 5 respectively.
norbelladine(1+)
C15H18NO3 (260.12866180000003)
An organic cation obtained by protonation of the secondary amino group of norbelladine; major species at pH 7.3.
O-methylmalonylcarnitine(1-)
A dicarboxylic acid monoanion that is the conjugate base of O-methylmalonylcarnitine; major species at pH 7.3.
cyclo(L-phenylalanyl-L-leucyl)
A member of the class of 2,5-diketopiperazines that is piperazine-2,5-dione in which one hydrogen at position 3 and one hydrogen at position 6 are replaced by benzyl and isobutyl groups (the 3S,6S-diastereomer).
gamma-Glu-ile
A glutamyl-L-amino acid having L-isoleucine as the L-amino acid component.
DG(10:0)
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