Exact Mass: 274.004
Exact Mass Matches: 274.004
Found 431 metabolites which its exact mass value is equals to given mass value 274.004,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Bellidifolin
Bellidifolin is a member of the xanthone family that is bellidin substituted with a methyl group at O-3. A natural product found particularly in Swertia chirata and Gentianella campestris. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a hypoglycemic agent and a metabolite. It is a member of xanthones and a polyphenol. It is functionally related to a bellidin. Bellidifolin is a natural product found in Gentiana orbicularis, Gentianella amarella, and other organisms with data available. Bellidifolin is a xanthone isolated from the stems of Swertia punicea, with hepatoprotective, hypoglycemic, anti-oxidation, anti-inflammatory and antitumor activities[1][2][3]. Bellidifolin also acts as a viral protein R (Vpr) inhibitor[4]. Bellidifolin is a xanthone isolated from the stems of Swertia punicea, with hepatoprotective, hypoglycemic, anti-oxidation, anti-inflammatory and antitumor activities[1][2][3]. Bellidifolin also acts as a viral protein R (Vpr) inhibitor[4].
6-phospho-2-dehydro-D-gluconate
A ketoaldonic acid phosphate that is the 6-phospho derivative of 2-dehydro-D-gluconic acid.
4-Ketocyclophosphamide
4-Ketocyclophosphamide is a metabolite of cyclophosphamide. Cyclophosphamide (trade names Endoxan, Cytoxan, Neosar, Procytox, Revimmune), also known as cytophosphane, is a nitrogen mustard alkylating agent, from the oxazophorines group. An alkylating agent adds an alkyl group (CnH2n+1) to DNA. It attaches the alkyl group to the guanine base of DNA, at the number 7 nitrogen atom of the imidazole ring. It is used to treat various types of cancer and some autoimmune disorders. (Wikipedia) D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D010752 - Phosphoramide Mustards
Isoathyriol
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3 and 7 and a methoxy group at position 6.
Swertianin
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 2 and 8 and a methoxy group at position 6. It has been isolated from various species of the genus Swertia and has been found to exhibit antioxidant activities.
3-Dehydro-L-gulonate 6-phosphate
3-Dehydro-L-gulonate 6-phosphate is an intermediate in the metabolic pathways of glucose metabolism. Its chemical structure is characterized by a hexose sugar backbone with specific modifications. The "3-Dehydro" part of its name indicates the presence of a double bond at the third carbon atom due to the removal of two hydrogen atoms, which differentiates it from the corresponding sugar. The "L-gulonate" portion refers to its derivation from L-gulonic acid, a sugar acid. The "6-phosphate" indicates the presence of a phosphate group attached to the sixth carbon atom of the sugar. Biologically, 3-Dehydro-L-gulonate 6-phosphate plays a role in the metabolism of glucose. It is involved in the process of gluconeogenesis, which is the synthesis of glucose from non-carbohydrate sources, such as amino acids and glycerol. This pathway is particularly important during periods of fasting or low carbohydrate intake, where the body needs to maintain blood glucose levels for energy production. Additionally, 3-Dehydro-L-gulonate 6-phosphate may also be involved in other metabolic pathways, including the pentose phosphate pathway, which is important for the production of NADPH (an important reducing agent in the cell) and ribose-5-phosphate (a precursor for nucleotide synthesis). In summary, 3-Dehydro-L-gulonate 6-phosphate is a chemically modified sugar phosphate that serves as an intermediate in various metabolic pathways, particularly in the synthesis and breakdown of glucose. Its presence and regulation are crucial for maintaining energy balance and providing necessary building blocks for cellular processes in living organisms.
4-Ketoifosfamide
4-Ketoifosfamide is a metabolite of ifosfamide. Ifosfamide (also marketed as Mitoxana and Ifex) is a nitrogen mustard alkylating agent used in the treatment of cancer. It is sometimes abbreviated IFO. (Wikipedia) D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D010752 - Phosphoramide Mustards
Disulfoton
C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals
D-Glucuronic acid 1-phosphate
D-Glucuronic acid 1-phosphate is an end product of the UDP-glucuronic acid pathway. Formation of free glucuronic acid from UDP-glucuronic acid can be considered as the first step in the synthesis of vitamin C, a pathway that occurs in most vertebrates, although not in guinea pigs and primates, including humans. Free glucuronic acid can also be converted to pentose phosphate intermediates via the pentose pathway. The latter is interrupted in subjects with pentosuria, who have a deficiency in l-xylulose reductase (EC 1.1.1.10, an enzyme that belongs to the short-chain dehydrogenase/reductase family) and excrete abnormal amounts of l-xylulose. Some xenobiotics stimulate the formation of vitamin C in animals and enhance the excretion of l-xylulose in humans with pentosuria and have shown that aminopyrine, metyrapone and other xenobiotics cause an almost instantaneous increase in the conversion of UDP-glucuronic acid to glucuronic acid. It is usually stated that glucuronic acid formation from UDP-glucuronic acid is the result of two successive reactions comprising the hydrolysis of UDP-glucuronic acid to glucuronic acid 1-phosphate and UMP by nucleotide pyrophosphatase (E-NPP3, EC 3.6.1.9), followed by dephosphorylation of glucuronic acid 1-phosphate. Glucuronidation is responsible for conjugating potentially toxic lipophilic compounds with glucuronic acid, thereby producing molecules with greater aqueous solubility that is excreted more readily into urine and bile. The rate at which any compound may be glucuronidated depends on the concentration and activity of the UDP-glucuronosyltransferases as well as the concentration of the cofactor UDP-glucuronic acid. UDP-glucuronic acid is formed after oxidation of UDP-glucose by UDP-glucose dehydrogenase (UGDH, EC 1.1.1.22) with NAD as the electron acceptor. UDP-glucuronic acid may then be either used as the glucuronic acid donor for xenobiotic conjugation reactions by UDPglucuronosyltransferases (GlcAT-P, EC 2.4.1.17), or degraded to D-glucuronic acid 1-phosphate after the phosphodiester bond is cleaved by E-NPP3. E-NPP3 is the same enzyme that further reduces D-Glucuronic acid 1-phosphate to free D-glucuronic acid. Decreases in UDP-glucuronic acid concentration may be due to reduced availability of UDP-glucose or decreased UGDH activity or to increased activities of GlcAT-P or E-NPP3. Exposure to volatile anesthetics reduces hepatic UDP-glucuronic acid concentrations, and alters the rate of conjugation of compounds such as acetaminophen, bilirubin, diethylstilbestrol, iopanoic acid and valproic acid in a non-sex-dependent fashion in experimental mice. The depletion of UDP-glucuronic acid by anesthetics is caused by altered activity of microsomal E-NPP3. (PMID: 2167093, 16689937, 1276) [HMDB] D-Glucuronic acid 1-phosphate is an end product of the UDP-glucuronic acid pathway. Formation of free glucuronic acid from UDP-glucuronic acid can be considered as the first step in the synthesis of vitamin C, a pathway that occurs in most vertebrates, although not in guinea pigs and primates, including humans. Free glucuronic acid can also be converted to pentose phosphate intermediates via the pentose pathway. The latter is interrupted in subjects with pentosuria, who have a deficiency in l-xylulose reductase (EC 1.1.1.10, an enzyme that belongs to the short-chain dehydrogenase/reductase family) and excrete abnormal amounts of l-xylulose. Some xenobiotics stimulate the formation of vitamin C in animals and enhance the excretion of l-xylulose in humans with pentosuria and have shown that aminopyrine, metyrapone and other xenobiotics cause an almost instantaneous increase in the conversion of UDP-glucuronic acid to glucuronic acid. It is usually stated that glucuronic acid formation from UDP-glucuronic acid is the result of two successive reactions comprising the hydrolysis of UDP-glucuronic acid to glucuronic acid 1-phosphate and UMP by nucleotide pyrophosphatase (E-NPP3, EC 3.6.1.9), followed by dephosphorylation of glucuronic acid 1-phosphate. Glucuronidation is responsible for conjugating potentially toxic lipophilic compounds with glucuronic acid, thereby producing molecules with greater aqueous solubility that is excreted more readily into urine and bile. The rate at which any compound may be glucuronidated depends on the concentration and activity of the UDP-glucuronosyltransferases as well as the concentration of the cofactor UDP-glucuronic acid. UDP-glucuronic acid is formed after oxidation of UDP-glucose by UDP-glucose dehydrogenase (UGDH, EC 1.1.1.22) with NAD as the electron acceptor. UDP-glucuronic acid may then be either used as the glucuronic acid donor for xenobiotic conjugation reactions by UDPglucuronosyltransferases (GlcAT-P, EC 2.4.1.17), or degraded to D-glucuronic acid 1-phosphate after the phosphodiester bond is cleaved by E-NPP3. E-NPP3 is the same enzyme that further reduces D-Glucuronic acid 1-phosphate to free D-glucuronic acid. Decreases in UDP-glucuronic acid concentration may be due to reduced availability of UDP-glucose or decreased UGDH activity or to increased activities of GlcAT-P or E-NPP3. Exposure to volatile anesthetics reduces hepatic UDP-glucuronic acid concentrations, and alters the rate of conjugation of compounds such as acetaminophen, bilirubin, diethylstilbestrol, iopanoic acid and valproic acid in a non-sex-dependent fashion in experimental mice. The depletion of UDP-glucuronic acid by anesthetics is caused by altered activity of microsomal E-NPP3. (PMID: 2167093, 16689937, 1276).
1,3,6-Trihydroxy-5-methoxyxanthone
1,3,6-Trihydroxy-5-methoxyxanthone is a member of xanthones. 1,3,6-Trihydroxy-5-methoxyxanthone is a natural product found in Hypericum chinense, Canscora alata, and other organisms with data available. 1,3,6-Trihydroxy-5-methoxyxanthone is found in fruits. 1,3,6-Trihydroxy-5-methoxyxanthone is a constituent of Garcinia dulcis (mundu). Constituent of Garcinia dulcis (mundu). 1,3,6-Trihydroxy-5-methoxyxanthone is found in fruits.
BR-Xanthone B
Constituent of the dry fruit hulls of Garcinia mangostana (mangosteen). BR-Xanthone B is found in fruits and purple mangosteen. BR-Xanthone B is found in fruits. BR-Xanthone B is a constituent of the dry fruit hulls of Garcinia mangostana (mangosteen).
Ferulic acid 4-sulfate
Ferulic acid 4-O-sulfate (CAS: 86321-29-1) is a phenolic acid metabolite. It is also a coffee metabolite found in blood or urine. Ferulic acid 4-O-sulfate was found to be elevated in rat urine after whole rye consumption which makes this compound a potential urinary biomarker of whole grain intake (PMID: 26862900). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
Alloathyriol
Alloathyriol is found in fruits. Alloathyriol is a constituent of Garcinia dulcis (mundu). Constituent of Garcinia dulcis (mundu). Alloathyriol is found in fruits.
Ribose-1-arsenate
Ribose-1-arsenate is an intermediate in arsenate detoxification I pathway. Arsenic detoxification in most mammals involves alternative steps of reduction and oxidative methylation. The end metabolites are methylarsonate,cacodylate, and dimethylarsinous acid,which are less reactive than arsenate and arsenite, and are excreted in the urine.The pathway starts with the reduction of arsenate to arsenite. In this process,arsenate can be conjugate to ribose by the enzyme purine nucleoside phosphorylase (PNP), which accepts arsenate as an alternative substrate to its normal substrate, phosphate. The ribose-1-arsenate thus formed is converted to arsenite in the presence of dihydrolipoate, in a process that has not been fully characterized yet. [HMDB]. Ribose-1-arsenate is found in many foods, some of which are japanese walnut, yam, black-eyed pea, and lovage. Ribose-1-arsenate is an intermediate in arsenate detoxification I pathway. Arsenic detoxification in most mammals involves alternative steps of reduction and oxidative methylation. The end metabolites are methylarsonate,cacodylate, and dimethylarsinous acid,which are less reactive than arsenate and arsenite, and are excreted in the urine.The pathway starts with the reduction of arsenate to arsenite. In this process,arsenate can be conjugate to ribose by the enzyme purine nucleoside phosphorylase (PNP), which accepts arsenate as an alternative substrate to its normal substrate, phosphate. The ribose-1-arsenate thus formed is converted to arsenite in the presence of dihydrolipoate, in a process that has not been fully characterized yet.
Isoferulic acid 3-sulfate
Isoferulic acid 3-sulfate is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
4-Hydroxy-5-(phenyl)-valeric acid-O-sulphate
4-Hydroxy-5-(phenyl)-valeric acid-O-sulphate is a conjugate of 4-hydroxy-5-(phenyl)-valeric acid and sulphate.
Malathion dicarboxylic acid
Malathion dicarboxylic acid is a metabolite of malathion. Malathion is an organophosphate parasympathomimetic which binds irreversibly to cholinesterase. Malathion is an insecticide of relatively low human toxicity; however, a 2010 study has shown that children with higher levels of organophosphate pesticide metabolites in their urine are more likely to have attention deficit hyperactivity disorder. In the former USSR it was known as carbophos, in New Zealand and Australia as maldison and in South Africa as mercaptothion. (Wikipedia)
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-sulfooxyoxane-2-carboxylic acid
Heptulose
Heptulose-2-phosphate, also known as 1-deoxygluco-heptulose 2-phosphate, is a member of the class of compounds known as monosaccharide phosphates. Monosaccharide phosphates are monosaccharides comprising a phosphated group linked to the carbohydrate unit. Heptulose-2-phosphate is soluble (in water) and a moderately acidic compound (based on its pKa). Heptulose-2-phosphate can be found in garden tomato (variety) and sweet orange, which makes heptulose-2-phosphate a potential biomarker for the consumption of these food products. .
1,2,4-trichloro-5-(2-chloroethenyl)-1,5-dimethylcyclohexane
Ensulizole
C1892 - Chemopreventive Agent > C851 - Sunscreen CONFIDENCE standard compound; INTERNAL_ID 2859 CONFIDENCE standard compound; INTERNAL_ID 8787 CONFIDENCE standard compound; INTERNAL_ID 8238 CONFIDENCE standard compound; INTERNAL_ID 4172
ethyl 5-sulfanyl[1,2,3]triazolo[1,5-a]quinazoline-3-carboxylate
3-[(2,6-dichlorobenzyl)sulfanyl]-1H-1,2,4-triazol-5-amine
dimethyl 5-sulphoisophthalate
CONFIDENCE standard compound; INTERNAL_ID 2311
5-methyl-[5-4(4-acetoxy-1-butynyl)]-2,2-bisthiophene
Montixanthone
Montixanthone is a natural product found in Hypericum beanii with data available.
(1R,6R,9S,10S)-9-Chloro-10-hydroxy-8-methoxycarbonyl-4-methylene-2,5-dioxabicyclo<4.4.0>dec-3-one-7-ene|(1R,6R,9S,10S)-9-Chloro-10-hydroxy-8-methoxycarbonyl-4-methylene-2,5-dioxabicyclo[4.4.0]dec-3-one-7-ene
5,8,10-Trihydroxy-2-methyl-2H-naphtho[2,3-b]pyran-6,9-dione
1-(3-bromo-2-hydroxyl-4,6- dimethoxyphenyl)ethanone
Isobellidifolin
Isobellidifolin is a natural product found in Gentiana orbicularis, Gentianella florida, and other organisms with data available.
Phenylbenzimidazole sulfonic acid
CONFIDENCE Reference Standard (Level 1)
2,3,6,8-tetrahydroxy-1-methylxanthen-9-one
5-chloro-4,6,8-trihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
Ferulic acid 4-sulfate
A member of the class of cinnamic acids that is ferulic acid in which the phenolic hydrogen has been replaced by a sulfo group.
4-Amino-2-chloro-5-(1H-tetrazol-5-yl)benzenesulfonamide
2-chloro-N-(4-(trifluoromethyl)pyridin-2-yl)pyrimidin-4-amine
2H-Pyran-5-carboxylicacid, 3-bromo-4,6-dimethyl-2-oxo-, ethyl ester
1-((4-BROMOTHIOPHEN-2-YL)METHYL)-4-METHYLPIPERAZINE
2-Thiophenecarboxamide,N-(6-methyl-2-benzothiazolyl)-
2-BROMO-5-FLUORO-BENZENEPROPANOIC ACID ETHYL ESTER
1H-Benzimidazole,2-[[(4-chlorophenyl)methyl]thio]-
5-IODO-7-METHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-4-AMINE
2,4-dichloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine
2-bromo-7,7-dimethyl-6,8-dihydro-5H-[1,3]thiazolo[5,4-c]azepin-4-one
1-(4-chlorobenzenesulfonyl)-3,3-dimethylbutane-2-one
(4-FLUORO-BENZYL)-PYRIDIN-2-YL-AMINE DIHYDROCHLORIDE
4-methyl-2-pyridin-4-yl-1,3-thiazole-5-carbonyl chloride,hydrochloride
2,2-dichloro-1-(4-ethoxyphenyl)cyclopropane-1-carboxylic acid
ETHYL5-BROMO-1-TERT-BUTYL-1H-PYRAZOLE-4-CARBOXYLATE
4-(CHLOROMETHYL)-N-(4-METHYLPHENYL)-1,3-THIAZOL-2-AMINE HYDROCHLORIDE
6,8-DICHLORO-CHROMAN-3-CARBOXYLIC ACID ETHYL ESTER
2-(Methyl(phenyl)amino)-4H-thieno[3,2-d][1,3]thiazin-4-one
6-(4-METHYLPHENYLTHIO)IMIDAZO[2,1-B]THIAZOLE-5-CARBOXALDEHYDE
4-(4-Chloro-1H-pyrazolo[3,4-d]pyrimidin-1-yl)benzoic acid
(7-BROMO-2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)(4-BROMOPHENYL)METHANONE
4-Chloro-5,6-dimethyl-2-phenylthieno[2,3-d]pyrimidine
3-(Trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine dihydrochloride
N-[(m-Nitrophenyl)sulfonyl]carbamic acid ethyl ester
2-chloro-6-[(E)-2-(4-chlorophenyl)ethenyl]pyridine-3-carbonitrile
5-(2,4-DICHLORO-5-FLUOROPHENYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
2-(2-(4-Chlorophenyl)thiazol-4-yl)ethanamine hydrochloride
4-chloro-6-(4-nitrophenyl)-7H-pyrrolo[2,3-d]pyrimidine
5-(2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL)FURAN-2-CARBALDEHYDE
3-METHOXY-5-(TRIFLUOROMETHYL)BENZENESULPHONYL CHLORIDE
2-(2,4-Dichlorophenyl)-2-methyl-4-propyl-1,3-dioxolane
(2-PHENYL-4-THIOPHEN-2-YL-THIAZOL-5-YL)-ACETICACID
methyl 4-chlorosulfonyl-2,3-dihydro-1H-indene-2-carboxylate
3-Bromo-6-methyl-2-oxo-1(2H)-pyrazineacetic acid ethyl ester
1-(5-Chloro-2-hydroxyphenyl)-3-phenyl-1,3-propanedione
3-trifluoromethyl-1-phenyl-1H-5-chloropyrazole-4-carbaldehyde
2-benzylsulfanyl-7-hydroxy-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
6-(2-methoxyphenyl)-1H-thieno[3,2-d]pyrimidine-2,4-dione
METHYL 5-[(4,5-DICHLORO-1H-IMIDAZOL-1-YL)METHYL]-2-FUROATE
4-[3-(TRIFLUOROMETHYL)-1H-PYRAZOL-1-YL]BENZOYL CHLORIDE
1-phenyl-5-(trifluoromethyl)pyrazole-4-carbonyl chloride
Nickel,bis(2,4-pentanedionato-kO,kO)-, hydrate, (SP-4-1)- (9CI)
1H-Pyrazole-5-carboxylic acid, 4-bromo-1-methyl-3-(1-methylethyl)-, ethyl ester
1-(4-Bromophenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
2-(Bromodifluoromethyl)-1-phenyl-4,5-dihydro-1H-imidazole
2,4-Dichloro-5-(trifluoromethoxy)phenylboronic acid
5-(2-CHLORO-4-(TRIFLUOROMETHYL)PHENYL)FURAN-2-CARBALDEHYDE
5-Bromo-1-isopropyl-1H-benzo[d]imidazole hydrochloride
6-[(2-HYDROXYETHYL)THIO]-1H,3H-NAPHTHO[1,8-CD]PYRAN-1,3-DIONE
5-Bromo-1-propyl-1H-benzo[d]imidazole hydrochloride
TERT-BUTYL 4-BROMO-3,5-DIMETHYL-1H-PYRAZOLE-1-CARBOXYLATE
3-(2-Chloroactyl)-2-[(2-chloroethyl)amino]tetrahydro-2H-1,3,2-oxazaphosphorine-2-oxide
2,6-Anhydro-1-deoxy-1-phosphono-D-glycero-D-gulo-heptitol
Technetium Tc-99m medronate anhydrous
V - Various > V09 - Diagnostic radiopharmaceuticals > V09B - Skeleton > V09BA - Technetium (99mtc) compounds D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019275 - Radiopharmaceuticals D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates
5-(4-Methoxyphenyl)-6-sulfanylidene-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one
2-(1H-benzimidazol-2-ylthio)-1-thiophen-2-ylethanone
(E)-3-(3,5-dichlorophenyl)-2-pyridin-3-ylprop-2-enenitrile
D000970 - Antineoplastic Agents > D020032 - Tyrphostins
3-Amino-5-(4-bromophenyl)-4-pyridazinecarbonitrile
3-benzyl-2-sulfanyl-3H,4H-thieno[3,2-d]pyrimidin-4-one
2-[[(4-Chlorophenyl)thio]methyl]imidazo[1,2-a]pyridine
2-Keto-6-phosphate-D-gluconic acid, alpha-furanose form
Bellidofolin
Bellidifolin is a xanthone isolated from the stems of Swertia punicea, with hepatoprotective, hypoglycemic, anti-oxidation, anti-inflammatory and antitumor activities[1][2][3]. Bellidifolin also acts as a viral protein R (Vpr) inhibitor[4]. Bellidifolin is a xanthone isolated from the stems of Swertia punicea, with hepatoprotective, hypoglycemic, anti-oxidation, anti-inflammatory and antitumor activities[1][2][3]. Bellidifolin also acts as a viral protein R (Vpr) inhibitor[4].
(2,3,4,5-Tetrahydroxy-6-oxoheptyl) dihydrogen phosphate
3-dehydro-L-gulonic acid 6-phosphate
A ketoaldonic acid derivative that is the 6-(dihydrogen phosphate) derivative of 3-dehydro-L-gulonic acid.
[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxyarsonic acid
2-[4-(methylthio)butyl]-sulfinylhydroximate-O-sulfate
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-sulfooxyoxane-2-carboxylic acid
D-Glucuronic acid 1-phosphate
A uronic acid phosphate consisting of D-glucuronic acid having a phosphate group attached at the 1-position.
N-(2-chloropyridin-3-yl)-3-oxo-3-phenylpropanamide
2-(4-Chlorophenyl)-5-(4-fluorophenyl)-1,3,4-oxadiazole
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-3-pyridinecarboxamide
2-(3,5-Dichlorophenyl)-5-(methylthio)-1,2,4-triazol-3-amine
[2,6-Dihydroxy-3-(3-methylbut-2-enyl)phenyl] hydrogen sulate
2-(2,4-Dihydroxy-6-oxidobenzoyl)-5-hydroxy-3-methylbenzenolate
Methyl 3,5-dichloro-2-hydroxy-4-(2-propynoxy)benzoate
Bellidifolin
Bellidifolin is a member of the xanthone family that is bellidin substituted with a methyl group at O-3. A natural product found particularly in Swertia chirata and Gentianella campestris. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a hypoglycemic agent and a metabolite. It is a member of xanthones and a polyphenol. It is functionally related to a bellidin. Bellidifolin is a natural product found in Gentiana orbicularis, Gentianella amarella, and other organisms with data available. A member of the xanthone family that is bellidin substituted with a methyl group at O-3. A natural product found particularly in Swertia chirata and Gentianella campestris. Bellidifolin is a xanthone isolated from the stems of Swertia punicea, with hepatoprotective, hypoglycemic, anti-oxidation, anti-inflammatory and antitumor activities[1][2][3]. Bellidifolin also acts as a viral protein R (Vpr) inhibitor[4]. Bellidifolin is a xanthone isolated from the stems of Swertia punicea, with hepatoprotective, hypoglycemic, anti-oxidation, anti-inflammatory and antitumor activities[1][2][3]. Bellidifolin also acts as a viral protein R (Vpr) inhibitor[4].
Disulfaton
C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals
4-Ketocyclophosphamide
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D010752 - Phosphoramide Mustards
α-D-Glucuronic acid-1-phosphate
The 1-O-phospho derivative of alpha-D-glucuronic acid.
1-phospho-alpha-D-galacturonic acid
An uronic acid phosphate that is alpha-D-galacturonic acid carrying a phosphate group at position 1.
4-Ketoifosfamide
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D010752 - Phosphoramide Mustards
D-Glucuronate 1-phosphate
A carbohydrate acid derivative anion arising from selective deprotonation of the carboxy function of D-glucuronic acid 1-phosphate.
[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxy-6-oxoheptyl]oxyphosphonic acid
5,7-dihydroxy-1-(1-hydroxyethyl)naphtho[2,3-c]furan-4,9-dione
6-{5'-methyl-[2,2'-bithiophen]-5-yl}hex-5-yn-2-one
(2,3,4,5-tetrahydroxy-6-oxoheptyl)oxyphosphonic acid
(1r,2s,4s,5s)-1,2,4-trichloro-5-[(1e)-2-chloroethenyl]-1,5-dimethylcyclohexane
5-{2,5-dihydroxy-3h-imidazo[4,5-b]pyridin-6-yl}-6-hydroxypyridine-2,3-dione
6,8-dihydroxy-7-methoxy-1-methylnaphtho[2,3-c]furan-4,9-dione
1,3,5-trihydroxy-2-methoxyxanthone
{"Ingredient_id": "HBIN001065","Ingredient_name": "1,3,5-trihydroxy-2-methoxyxanthone","Alias": "NA","Ingredient_formula": "C14H10O6","Ingredient_Smile": "COC1=C(C=C2C(=C1O)C(=O)C3=C(O2)C(=CC=C3)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21774","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1,3,7-trihydroxyl-8-methoxyxanthone
{"Ingredient_id": "HBIN001114","Ingredient_name": "1,3,7-trihydroxyl-8-methoxyxanthone","Alias": "NA","Ingredient_formula": "C14H10O6","Ingredient_Smile": "COC1=C2C(=CC(=C1)O)C(=O)C3=C(C=C(C=C3O2)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21746","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1,3,8-trihydroxy-5-methoxy xanthones
{"Ingredient_id": "HBIN001121","Ingredient_name": "1,3,8-trihydroxy-5-methoxy xanthones","Alias": "NA","Ingredient_formula": "C14H10O6","Ingredient_Smile": "COC1=C2C(=C(C=C1)O)C(=O)C3=C(C=C(C=C3O2)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "43029","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
bellidifodin
{"Ingredient_id": "HBIN017727","Ingredient_name": "bellidifodin","Alias": "NA","Ingredient_formula": "C14H10O6","Ingredient_Smile": "COC1=CC(=C2C(=C1)OC3=C(C=CC(=C3C2=O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2220","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
