Exact Mass: 253.0434436
Exact Mass Matches: 253.0434436
Found 479 metabolites which its exact mass value is equals to given mass value 253.0434436,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
L-Threoneopterin
C9H11N5O4 (253.08110059999998)
L-Threoneopterin is a catabolic product of GTP. It is synthesized by macrophages upon stimulation by interferon-gamma. It is used as a marker of HIV infection. It belongs to the chemical group known as pterins. Neopterin is a pteridine derivative present in body fluids; elevated levels result from immune system activation, malignant disease, allograft rejection, and viral infections (From Stedman, 26th ed). Neopterin also serves as a precursor in the biosynthesis of biopterin. Neopterin is a catabolic product of GTP. It is synthesised by macrophages upon stimulation with interferon-gamma. It is used as a marker of HIV infection. It belongs to the chemical group known as pterins.A pteridine derivative present in body fluids; elevated levels result from immune system activation, malignant disease, allograft rejection, and viral infections. (From Stedman, 26th ed) Neopterin also serves as a precursor in the biosynthesis of biopterin. [HMDB] Neopterin (D-(+)-Neopterin), a catabolic product of guanosine triphosphate (GTM), serves as a marker of cellular immune system activation.
Sulfamethoxazole
Sulfamethoxazole is only found in individuals that have used or taken this drug. It is a bacteriostatic antibacterial agent that interferes with folic acid synthesis in susceptible bacteria. Its broad spectrum of activity has been limited by the development of resistance. (From Martindale, The Extra Pharmacopoeia, 30th ed, p208)Sulfonamides inhibit the enzymatic conversion of pteridine and p-aminobenzoic acid (PABA) to dihydropteroic acid by competing with PABA for binding to dihydrofolate synthetase, an intermediate of tetrahydrofolic acid (THF) synthesis. THF is required for the synthesis of purines and dTMP and inhibition of its synthesis inhibits bacterial growth. Pyrimethamine and trimethoprim inhibit dihydrofolate reductase, another step in THF synthesis, and therefore act synergistically with the sulfonamides. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01E - Sulfonamides and trimethoprim > J01EC - Intermediate-acting sulfonamides COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides CONFIDENCE standard compound; EAWAG_UCHEM_ID 298 CONFIDENCE standard compound; INTERNAL_ID 1018 Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Tizanidine
C9H8ClN5S (253.01889179999998)
Tizanidine is a short-acting drug for the management of spasticity. Tizanidine is an agonist at a2-adrenergic receptor sites and presumably reduces spasticity by increasing presynaptic inhibition of motor neurons. In animal models, tizanidine has no direct effect on skeletal muscle fibers or the neuromuscular junction, and no major effect on monosynaptic spinal reflexes. The effects of tizanidine are greatest on polysynaptic pathways. The overall effect of these actions is thought to reduce facilitation of spinal motor neurons. Tizanidine has two major metabolites: (1) 5-chloro-4-(2-imidazolin-4-on-2-ylamino)-2,1,3-benzothiazdiazole and (2) 5-chloro-4-(2-imidazolin-4-on-2-ylamino)-2,1,3-benzothiadiazole (PMID: 9929503, 19961320). M - Musculo-skeletal system > M03 - Muscle relaxants > M03B - Muscle relaxants, centrally acting agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D002491 - Central Nervous System Agents > D000700 - Analgesics Tizanidine is an α2-adrenergic receptor agonist and inhibits neurotransmitter release from CNS noradrenergic neurons. Target: α2-adrenergic receptor Tizanidine is a drug that is used as a muscle relaxant. It is a centrally acting α2 adrenergic agonist. It is used to treat the spasms, cramping, and tightness of muscles caused by medical problems such as multiple sclerosis, ALS, spastic diplegia, back pain, or certain other injuries to the spine or central nervous system. It is also prescribed off-label for migraine headaches, as a sleep aid, and as an anticonvulsant. It is also prescribed for some symptoms of fibromyalgia. Tizanidine has been found to be as effective as other antispasmodic drugs and has superior tolerability to that of baclofen and diazepam. Tizanidine can be very strong even at the 2 mg dose and may cause hypotension, so caution is advised when it is used in patients who have a history of orthostatic hypotension, or when switching from gel cap to tablet form and vice versa. Tizanidine can occasionally cause liver damage, generally the hepatocellular type. Clinical trials show that up to 5\% of patients treated with tizanidine had elevated liver function test values, though symptoms disappeared upon withdrawal of the drug. Care should be used when first beginning treatment with tizanidine with regular liver tests for the first 6 months of treatment.
(2-Mercaptomethyl-3-phenyl-propionyl)-glycine
D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors
D-erythro-Eritadenine
C9H11N5O4 (253.08110059999998)
D-erythro-Eritadenine is found in mushrooms. D-erythro-Eritadenine is isolated from the edible shitake mushroo D004791 - Enzyme Inhibitors
N-Salicyloylaspartic acid
Constituent of kidney beans (Phaseolus vulgaris) and grape (Vitis subspecies). N-Salicyloylaspartic acid is found in many foods, some of which are green bean, yellow wax bean, pulses, and fruits. N-Salicyloylaspartic acid is found in fruits. N-Salicyloylaspartic acid is a constituent of kidney beans (Phaseolus vulgaris) and grape (Vitis species).
Neopterin
C9H11N5O4 (253.08110059999998)
Neopterin, also known as monapterin, belongs to the class of organic compounds known as biopterins and derivatives. These are coenzymes containing a 2-amino-pteridine-4-one derivative and are mainly synthesized in several parts of the body, including the pineal gland. Neopterin is a solid that is soluble in water. Neopterin is a catabolic product of guanosine triphosphate (GTP). In humans, it is involved in pterine biosynthesis and it also serves as a precursor in the biosynthesis of biopterin, which is an essential cofactor in neurotransmitter synthesis. Neopterin has been identified as a uremic toxin according to the European Uremic Toxin Working Group (PMID: 22626821). Most uremic toxins are metabolic waste products and are normally excreted in the urine or feces. Uremic toxins can cause kidney, liver and heart damage. They can also cause changes in mental status, such as confusion, reduced awareness, agitation, psychosis, seizures, and coma. Uremic toxins such as neopterin are actively transported into the kidneys via organic ion transporters (especially OAT3). Elevated levels of neopterin result from immune system activation, including from malignant cancer, allograft rejection, viral infection, and autoimmune disorders (PMID: 19500901). Measurement of neopterin concentration allows estimation of the extent of oxidative stress elicited by the immune system. Neopterin concentrations usually correlate with the extent and activity of a given disease, and are also used to monitor the course of the disease. Elevated neopterin concentrations are among the best predictors of adverse outcome in patients with HIV infection, in cardiovascular disease, and in various types of cancer. Neopterin (D-(+)-Neopterin), a catabolic product of guanosine triphosphate (GTM), serves as a marker of cellular immune system activation.
Umanopterin
C9H11N5O4 (253.08110059999998)
Umanopterin is a pteridine derivative. It is identified in body fluids. An elevated level of umanopterin is associated with immune system activation, malignant diseases, allograft rejection, and viral infections. (http://www.online-medical-dictionary.org/) [HMDB] Umanopterin is a pteridine derivative. It is identified in body fluids. An elevated level of umanopterin is associated with immune system activation, malignant diseases, allograft rejection, and viral infections (http://www.online-medical-dictionary.org/). Neopterin (D-(+)-Neopterin), a catabolic product of guanosine triphosphate (GTM), serves as a marker of cellular immune system activation.
Hydroxysepiapterin
C9H11N5O4 (253.08110059999998)
3-hydroxysepiapterin is found in high concentration in the urine of patients with DHBS(dihydrobiopterin synthetase ) deficiency.(PMID: 7005193) [HMDB] 3-hydroxysepiapterin is found in high concentration in the urine of patients with DHBS(dihydrobiopterin synthetase) deficiency.(PMID: 7005193).
5-Hydroxyketamine
5-Hydroxyketamine is only found in individuals that have used or taken Ketamine. 5-Hydroxyketamine is a metabolite of Ketamine. 5-hydroxyketamine belongs to the family of Phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
4-Hydroxyketamine
4-Hydroxyketamine is only found in individuals that have used or taken Ketamine. 4-Hydroxyketamine is a metabolite of Ketamine. 4-hydroxyketamine belongs to the family of Phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
6-Hydroxyketamine
6-Hydroxyketamine is a metabolite of Ketamine. Ketamine is a drug used in human and veterinary medicine, primarily for the induction and maintenance of general anesthesia, usually in combination with a sedative. (Wikipedia)
2-(1,2,3,4-Tetrahydroxybutyl)thiazolidine-4-carboxylic acid
1-Naphthalenesulfonic acid, 4-hydroxy-3-nitroso-
C10H7NO5S (253.00449319999998)
3'-AZIDO-2',3'-DIDEOXYURIDINE
C9H11N5O4 (253.08110059999998)
Cridanimod
L - Antineoplastic and immunomodulating agents > L03 - Immunostimulants > L03A - Immunostimulants D007155 - Immunologic Factors > D007369 - Interferon Inducers C2140 - Adjuvant
Deferitrin
Dioxolane guanosine
C9H11N5O4 (253.08110059999998)
Furegrelate
C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor
Novuridine
C9H11N5O4 (253.08110059999998)
[(2R,3R,4R)-3,4,5-Trihydroxy-1-oxopentan-2-yl] (2R)-2-amino-3-sulfanylpropanoate
2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyrimidine
4-[2-(4-chlorophenyl)ethylamino]-4-oxobut-2-enoic acid
4-(1,1-dioxido-2,3-dihydro-1-benzothien-3-yl)morpholine
Spermidine trihydrochloride
Spermidine hydrochloride maintains cell membrane stability, increases antioxidant enzymes activities, improving photosystem II (PSII), and relevant gene expression. Spermidine hydrochloride significantly decreases the H2O2 and O2.- contents[1]. Spermidine hydrochloride maintains cell membrane stability, increases antioxidant enzymes activities, improving photosystem II (PSII), and relevant gene expression. Spermidine hydrochloride significantly decreases the H2O2 and O2.- contents[1].
Viridicatol
CONFIDENCE Penicillium sp. Viridicatol, a quinolinone alkaloid, is isolated from the fermentation of an endophytic fungus Penicillium sp. R22 in Nerium indicum. Viridicatol has strong antifungal activity against Staphylococcus aureus with MIC value of 15.6 μg/mL[1].
5-(3,3-dichloro-2-methylpropyl)-4-hydroxy-3,3-dimethyl-2-pyrrolidinone|dysidamide C
C10H17Cl2NO2 (253.06362820000004)
(Z)-O-methyltridentatol B|S,S-dimethyl (Z)-2-(4-methoxyphenyl)ethenyliminodithiocarbonate
C12H15NOS2 (253.05950199999998)
Spermidine HCl
Spermidine hydrochloride maintains cell membrane stability, increases antioxidant enzymes activities, improving photosystem II (PSII), and relevant gene expression. Spermidine hydrochloride significantly decreases the H2O2 and O2.- contents[1]. Spermidine hydrochloride maintains cell membrane stability, increases antioxidant enzymes activities, improving photosystem II (PSII), and relevant gene expression. Spermidine hydrochloride significantly decreases the H2O2 and O2.- contents[1].
sulfamethoxazole
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01E - Sulfonamides and trimethoprim > J01EC - Intermediate-acting sulfonamides An isoxazole (1,2-oxazole) compound having a methyl substituent at the 5-position and a 4-aminobenzenesulfonamido group at the 3-position. COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu); Flow Injection CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu) CONFIDENCE standard compound; INTERNAL_ID 2343 CONFIDENCE standard compound; INTERNAL_ID 8563 CONFIDENCE Reference Standard (Level 1) CONFIDENCE standard compound; INTERNAL_ID 1018
3-hydroxy-4-(3-hydroxyphenyl)-1H-quinolin-2-one
neopterin
C9H11N5O4 (253.08110059999998)
Neopterin (D-(+)-Neopterin), a catabolic product of guanosine triphosphate (GTM), serves as a marker of cellular immune system activation.
2-(2-bromophenyl)-4,4-dimethyl-4,5-dihydrooxazole
C11H12BrNO (253.01022019999996)
2-(3-bromophenyl)-4,4-dimethyl-4,5-dihydrooxazole
C11H12BrNO (253.01022019999996)
Acyclovir (9-Carboxymethoxymethylguanine
C9H11N5O4 (253.08110059999998)
Lentysine
C9H11N5O4 (253.08110059999998)
D004791 - Enzyme Inhibitors
Ketamine metabolite (Cyclohexanone, 2-(2-chlorophenyl)-5-hydroxy-2-(methylamino)-)
Ketamine metabolite (Cyclohexanone, 2-(2-chlorophenyl)-6-hydroxy-2-(methylamino)-)
3-Chloro-4-(4-chlorophenoxy)aniline
C12H9Cl2NO (253.00611639999997)
1-(4-BROMOPHENYL)-3-(DIMETHYLAMINO)-2-PROPEN-1-ONE
C11H12BrNO (253.01022019999996)
3-(2,3-DICHLORO-PHENOXY)-PHENYLAMINE
C12H9Cl2NO (253.00611639999997)
6-Chloro-3-(piperazin-1-yl)benzol[d]isothiazole
C11H12ClN3S (253.04404219999998)
Methyl 2-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)acetate
1-(4-FLUOROBENZOYL)-4-HYDROXY-2-PYRROLIDINECARBOXYLICACID
4H-Pyrano[2,3-b]pyridin-4-one, 2-(4-methoxyphenyl)-
Cinromide
C11H12BrNO (253.01022019999996)
C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent
6-Bromo-4,4-dimethyl-3,4-dihydroquinolin-2(1H)-one
C11H12BrNO (253.01022019999996)
4-Hydroxy-7-methylamino-2-naphthalenesulfonic acid
2-Thioxo-3-thiazolidinecarboxylic acid benzyl ester
4-hydroxy-6-methylamino-2-naphthalene sulfonic acid
navuridine
C9H11N5O4 (253.08110059999998)
D009676 - Noxae > D000963 - Antimetabolites > D015224 - Dideoxynucleosides 3′-Azido-2′,3′-dideoxyuridine (AzdU) is a nucleoside analog of Zidovudine (HY-17413). 3′-Azido-2′,3′-dideoxyuridine is a potent inhibitor of human immunodeficiency virus (HIV) replication in human peripheral blood mononuclear cells (PBMC) with limited toxicity for human bone marrow cells (BMC)[1][2][3]. 3′-Azido-2′,3′-dideoxyuridine is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. Strain-promoted alkyne-azide cycloaddition (SPAAC) can also occur with molecules containing DBCO or BCN groups.
4(1H)-Pyrimidinone,6-amino-1-(4-chlorophenyl)-2,3-dihydro-2-thioxo-
C10H8ClN3OS (253.00765879999997)
3-bromo-4-(2-methylpropoxy)benzonitrile
C11H12BrNO (253.01022019999996)
5-(ethoxycarbonylamino)benzene-1,3-dicarboxylic acid
4-(4-CHLOROPHENYL)-2-METHYL-5-THIAZOLECARBOXYLIC ACID
c-(2-chloro-phenyl)-c-phenyl-methylamine hydrochloride
METHYL 3,3,3-TRIFLUORO-N-(TRIFLUOROACETYL)ALANINATE
C6H5F6NO3 (253.01736119999998)
4-benzo[b]thiophen-3-yl-piperidine hydrochloride
C13H16ClNS (253.06919259999998)
1-(4-bromophenyl)-3-(dimethylamino)prop-2-en-1-one
C11H12BrNO (253.01022019999996)
3-(4-TRIFLUOROMETHYL-PHENOXY)-PHENYLAMINE
C13H10F3NO (253.07144459999998)
3-Pyridinecarboxylic acid, 2-chloro-5-(trifluoromethyl)-, ethyl ester
5-[4-(Methylsulfonamido)phenyl]-2H-tetrazole
C13H10F3NO (253.07144459999998)
2-BENZO[D]1,3-DIOXOLEN-5-YL-1,3-THIAZOLIDINE-4-CARBOXYLICACID
4-(4-(Trifluoromethyl)phenoxy)aniline
C13H10F3NO (253.07144459999998)
CYCLOPROPYLMETHYL-PYRIDIN-4-YL-AMINEDIHYDROCHLORIDE
(3-CHLORO-[1,1-BIPHENYL]-4-YL)METHANAMINE HYDROCHLORIDE
7-bromo-1,4,4-triMethyl-1,2,3,4-tetrahydroquinoline
2-(chloromethyl)-5-(3-methyl-4-nitrophenyl)-1,3,4-oxadiazole
2-[2-(2-CHLOROETHOXY)ETHYL]-1H-ISOINDOLE-1,3(2H)-DIONE
(3-Fluoro-5-(morpholine-4-carbonyl)phenyl)boronic acid
C11H13BFNO4 (253.09216200000003)
5-amino-2-(phenoxy)benzotrifluoride
C13H10F3NO (253.07144459999998)
7-bromo-3,4-dihydro-1H-isoquinoline-2-carboximidamide
C10H12BrN3 (253.02145319999997)
n-acetyl-s-benzyl-l-cysteine
The S-benzyl derivative of N-acetyl-L-cysteine.
1-acetyl-6-bromo-1,2,3,4-tetrahydroquinoline
C11H12BrNO (253.01022019999996)
methyl 1-[(2,6-difluorophenyl)methyl]triazole-4-carboxylate
METHYL 4-(5-AMINO-4-CYANO-2-FURYL)BENZOATE
C13H10F3NO (253.07144459999998)
7-CHLORO-IMIDAZO[1,2-B]PYRIDAZINE-2-CARBOXYLIC ACID, TERT-BUTYL ESTER
(4-Chloro-3-(pyrrolidine-1-carbonyl)phenyl)boronic acid
C11H13BClNO3 (253.06769680000002)
(3-Chloro-4-(pyrrolidine-1-carbonyl)phenyl)boronic acid
C11H13BClNO3 (253.06769680000002)
3-Pyrrolidinecarboxylic acid, 1-[(4-chlorophenyl)methyl]-5-oxo-
2-(4-chlorophenyl)-1-methyl-5-oxopyrrolidine-3-carboxylic acid
2-(HydroxyMethyl)-6-[4-(trifluoromethyl)phenyl]pyridine
C13H10F3NO (253.07144459999998)
6-bromo-1,4,4-triMethyl-1,2,3,4-tetrahydroquinoline
ETHYL 5,8-DIFLUORO-4-OXOHYDROQUINOLINE-3-CARBOXYLATE
C12H9F2NO3 (253.05504679999999)
2-(d-arabino-tetrahydroxybutyl)-4(r)-1,3-thiazolidine-4-carboxylic acid
ETHYL 4-CHLORO-1,3-DIMETHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLATE
3-bromo-2-tert-butylimidazo[1,2-a]pyrimidine
C10H12BrN3 (253.02145319999997)
2-(4-BROMO-PHENYL)-4,4-DIMETHYL-4,5-DIHYDRO-OXAZOLE
C11H12BrNO (253.01022019999996)
(2-Bromophenyl)(1-pyrrolidinyl)methanone
C11H12BrNO (253.01022019999996)
5-chloro-2-(2-chlorophenoxy)aniline
C12H9Cl2NO (253.00611639999997)
2,4-DICHLORO-4-AMINODIPHENYL ETHER
C12H9Cl2NO (253.00611639999997)
6-(4-methylbenzenesulfonyl)-2-oxa-6-azaspiro[3.3]heptane
Piperidine, 4-[[(cyclopropylmethyl)sulfonyl]methyl]-, hydrochloride (1:1)
C10H20ClNO2S (253.09032100000002)
6-Bromo-2,2-spirocyclopentane-2,3-dihydro-1H-imidazo[4,5-b]pyridine
C10H12BrN3 (253.02145319999997)
4-((TRIMETHYLSILYL)ETHYNYL)BENZENESULFONAMIDE
C11H15NO2SSi (253.05927300000002)
6-(trifluoromethyl)-2,3,4,9-tetrahydrocarbazol-1-one
C13H10F3NO (253.07144459999998)
2-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanylacetate
3-(3,4-DICHLORO-PHENOXY)-PHENYLAMINE
C12H9Cl2NO (253.00611639999997)
3-(3-TRIFLUOROMETHYL-PHENOXY)-PHENYLAMINE
C13H10F3NO (253.07144459999998)
4-(2-METHYL-1H-IMIDAZO[4,5-C]PYRIDIN-1-YL)BENZOIC ACID
Vanitiolide
C78276 - Agent Affecting Digestive System or Metabolism > C66913 - Cholagogues or Choleretic Agents
2-chloro-4-methyl-3-phenylquinoline
C16H12ClN (253.06582219999999)
2-chloro-7-methyl-3-phenylquinoline
C16H12ClN (253.06582219999999)
Ethyl 6,8-difluoro-4-hydroxyquinoline-3-carboxylate
C12H9F2NO3 (253.05504679999999)
Diethyl (4-Cyanobenzyl)phosphonate
C12H16NO3P (253.08677559999998)
1-(5-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-N,N-dimethylmethanamine
C10H12BrN3 (253.02145319999997)
2-(2-Bromophenyl)-N-cyclopropylacetamide
C11H12BrNO (253.01022019999996)
Ethyl 4-chloro-5-ethylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
1-(3-bromo-4-methylphenyl)pyrrolidin-2-one
C11H12BrNO (253.01022019999996)
4-Chloro-7-fluoroquinoline-3-carboxylic acid ethyl ester
4-Chloro-N-(4-chlorophenyl)-6-methyl-2-pyrimidinamine
C11H9Cl2N3 (253.01734939999997)
1-(4-CHLORO-BENZYL)-PIPERIDINE-4-CARBOXYLIC ACID HYDROCHLORIDE
1-PHENYL-5-(1H-PYRROL-1-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
2-NITRO-5-AMINO-3-(ACETYL-AMINO)-4-METHYLBENZOIC ACID
3-Amino-5-(4-chlorophenyl)thiophene-2-carboxylic acid
4-methyl-2,6-dioxo-4-phenyl-piperidine-3,5-dicarbonitrile
2-(2-Methyl-2H-pyrazol-3-yl)-quinoline-4-carboxylic acid
Methyl 3-(2,2,2-trifluoroacetamido)thiophene-2-carboxylate
1-(4-bromophenoxy)-2,3,4,5,6-pentadeuteriobenzene
C12H4BrD5O (253.01505828999998)
methyl 4-phenyl-1H-imidazo[4,5-c]pyridine-6-carboxylate
C-(3-CHLORO-PHENYL)-C-PHENYL-METHYLAMINE HYDROCHLORIDE
1-(2-Bromophenyl)-3-dimethylamino-2-propen-1-one
C11H12BrNO (253.01022019999996)
(6-[3-(TRIFLUOROMETHYL)PHENYL]PYRIDIN-3-YL)METHANOL
C13H10F3NO (253.07144459999998)
ETHYL 2-AMINO-4-(2-THIENYL)THIOPHENE-3-CARBOXYLATE
2-[2-(trifluoromethoxy)phenyl]aniline
C13H10F3NO (253.07144459999998)
1-ISOPROPYL-7-(METHYLTHIO)-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE
7-(METHYLTHIO)-1-PROPYL-1H-PYRIMIDO[4,5-D][1,3]OXAZINE-2,4-DIONE
1H-Pyrrolo[2,3-b]pyridine-3-propanoic acid, a-amino-6-chloro-4-Methyl-
1-(4-Bromo-1H-pyrrolo[2,3-b]pyridin-2-yl)-N,N-dimethylmethanamine
C10H12BrN3 (253.02145319999997)
3-Fluoro-4-(4-Morpholinylcarbonyl)benzeneboronic acid
C11H13BFNO4 (253.09216200000003)
2-Fluoro-4-(4-Morpholinylcarbonyl)benzeneboronic acid
C11H13BFNO4 (253.09216200000003)
ethyl 4-chloro-1-ethyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
[4-(4-Chlorophenyl)phenyl]methylamine hydrochloride
5-(Benzyloxy)-2,3-dichloropyridine
C12H9Cl2NO (253.00611639999997)
2-(CHLOROMETHYL)-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4-AMINE
C11H12ClN3S (253.04404219999998)
5-Chloro-2-(4-chlorophenoxy)aniline
C12H9Cl2NO (253.00611639999997)
6-bromo-2-tert-butylpyrazolo[1,5-a]pyrimidine
C10H12BrN3 (253.02145319999997)
[4-[(methylcarbamothioylamino)carbamoyl]phenyl]boronic acid
3-(6-Chloro-4-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-D-alanine
1-(4-Bromo-1H-pyrrolo[2,3-b]pyridin-3-yl)-N,N-dimethylmethanamine
C10H12BrN3 (253.02145319999997)
3-(Carboxymethoxy)thieno[2,3-b]pyridine-2-carboxylic acid
C10H7NO5S (253.00449319999998)
1-(4-FLUOROPHENYL)-4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[4,3-C]PYRIDINEHYDROCHLORIDE
C12H13ClFN3 (253.07819800000001)
1-(7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)ethanone
C11H12BrNO (253.01022019999996)
[4-(2-chlorophenyl)phenyl]methylamine hydrochloride
2-butanoyloxyethyl(trimethyl)azanium,bromide
C9H20BrNO2 (253.06773200000003)
(4-Fluoro-3-(morpholine-4-carbonyl)phenyl)boronic acid
C11H13BFNO4 (253.09216200000003)
(6-[4-(trifluoromethyl)phenyl]pyridin-3-yl)methanol
C13H10F3NO (253.07144459999998)
[6-(3,5-dichlorophenyl)pyridin-3-yl]methanol
C12H9Cl2NO (253.00611639999997)
2-Benzo[1,3]dioxol-5-yl-imidazo[1,2-a]pyridin-3-ylamine
7-BROMO-4,4-DIMETHYL-3,4-DIHYDROQUINOLIN-2(1H)-ONE
C11H12BrNO (253.01022019999996)
6-CHLORO-2-PIPERAZINO-1,3-BENZOTHIAZOLE
C11H12ClN3S (253.04404219999998)
ethyl 4-chloro-6-(trifluoromethyl)pyridine-2-carboxylate
2-BROMO-1-[3,4-DIHYDRO-1(2H)-QUINOLINYL]-1-ETHANONE
C11H12BrNO (253.01022019999996)
Acetone O-2,3,4,5,6-PFBHA-oxime
C10H8F5NO (253.05260179999996)
3-(4-fluorophenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine hydrochloride
C12H13ClFN3 (253.07819800000001)
4-chloro-6-methyl-2-phenylquinoline
C16H12ClN (253.06582219999999)
2-(4-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
ethyl 7-amino-2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
1-(4-bromophenyl)cyclobutanecarboxamide
C11H12BrNO (253.01022019999996)
a,a-Dimethyl-4-(trifluoromethyl)-Benzeneethanamine-hydrochloride
C11H15ClF3N (253.08450559999997)
3-(2-Methyl-5-nitro-1,3-benzodioxol-2-yl)propanoic acid
3(R)-CHLOROMETHYL-PYRROLIDINE-1-CARBOXYLIC ACID BENZYL ESTER
2-methyl-4-(3-chloro)phenyl thiazole-5-carboxylic acid
(2Z)-6-Hydroxy-7-methyl-2-(pyridin-3-ylmethylene)-1-benzofuran-3(2H)-one
(1-Imidazo[2,1-b][1,3]thiazol-6-ylpropyl)amine dihydrochloride
6-bromo-2-ethyl-8-methylimidazo[1,2-a]pyridin-3-amine
C10H12BrN3 (253.02145319999997)
2-(1,3-benzothiazol-2-ylsulfanyl)propanehydrazide
C10H11N3OS2 (253.03435159999998)
pfboa-propionaldehyde
C10H8F5NO (253.05260179999996)
1H-INDOLE,3-(2-BROMOETHYL)-5-METHOXY-
C11H12BrNO (253.01022019999996)
(2-Fluoro-5-(morpholine-4-carbonyl)phenyl)boronic acid
C11H13BFNO4 (253.09216200000003)
2-Bromo-4-(1-pyrrolidinyl)benzaldehyde
C11H12BrNO (253.01022019999996)
3-Bromo-4-(1-pyrrolidinyl)benzaldehyde
C11H12BrNO (253.01022019999996)
trans-1-(3-Bromophenyl)-3-dimethylamino-2-propen-1-one
C11H12BrNO (253.01022019999996)
3-[3-(Trifluoromethyl)phenoxy]-azetidine hydrochloride
N-[(2-Methyl-5-nitrophenyl)carbamothioyl]acetamide
5-(4-ETHOXY-PHENYLAMINO)-[1,3,4]THIADIAZOLE-2-THIOL
C10H11N3OS2 (253.03435159999998)
5-(Chloromethyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
C10H8ClN3OS (253.00765879999997)
5-(2-ETHOXY-PHENYLAMINO)-[1,3,4]THIADIAZOLE-2-THIOL
C10H11N3OS2 (253.03435159999998)
Ethyl 4-chloro-5-(trifluoromethyl)-pyridine-2-carboxylate
6-(TRIFLUOROMETHOXY)-1H-BENZIMIDAZOL-2-AMINEHYDROCHLORIDE
C8H7ClF3N3O (253.02297179999997)
5-(4-CHLORO-2-NITROPHENYL)-2H-TETRAZOLE
C13H10F3NO (253.07144459999998)
N-1-[3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN-2-YL]PROPANE-1,3-DIAMINE
(3-CHLOROMETHYL-PHENYL)-(4-HYDROXY-PIPERIDIN-1-YL)-METHANONE
Ethyl4-Methyl-2-(thiophen-2-yl)thiazole-5-carboxylate
m-(4,5-dihydro-5-imino-3-methyl-1H-pyrazol-1-yl)benzenesulphonic acid
N-methyl-N-[3-(trifluoromethyl)phenyl]carbamothioyl chloride
C9H7ClF3NS (252.99398079999997)
(4-Bromophenyl)(1-pyrrolidinyl)methanone
C11H12BrNO (253.01022019999996)
Verdiperstat
C26170 - Protective Agent > C1509 - Neuroprotective Agent COVID info from PDB, Protein Data Bank C471 - Enzyme Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
2-(1,2,3,4-Tetrahydroxybutyl)thiazolidine-4-carboxylic acid
5-(Hydroxyimino)-6-oxo-5,6-dihydronaphthalene-2-sulfonic acid
C10H7NO5S (253.00449319999998)
2-(4-Methoxyphenyl)-5-(3-pyridinyl)-1,3,4-oxadiazole
3-Acetamido-5-chloro-2-benzofurancarboxylic acid
C11H8ClNO4 (253.01418379999998)
4-Amino-N-(4-methyl-1,2-oxazol-3-yl)benzene-1-sulfonamide
2-(2-Bromophenyl)-4,4-dimethyl-4,5-dihydro-1,3-oxazole
C11H12BrNO (253.01022019999996)
2-(3-Bromophenyl)-4,5-dihydro-4,4-dimethyloxazole
C11H12BrNO (253.01022019999996)
2-Nitrophenylacetic acid trimethylsilyl ester
C11H15NO4Si (253.07703099999998)
3-{[(1R)-1-Benzyl-2-sulfanylethyl]amino}-3-oxopropanoic acid
Cridanimod
L - Antineoplastic and immunomodulating agents > L03 - Immunostimulants > L03A - Immunostimulants D007155 - Immunologic Factors > D007369 - Interferon Inducers C2140 - Adjuvant
Erythroneopterin
C9H11N5O4 (253.08110059999998)
Neopterin is a catabolic product of guanosine triphosphate (GTP), a purine nucleotide. Neopterin belongs to the chemical group known as pteridines. It is synthesised by macrophages upon stimulation with the cytokine interferon-gamma and is indicative of a pro-inflammatory immune status. Neopterin serves as a marker of cellular immune system activation. [Wikipedia]. Erythroneopterin is found in soy bean. Neopterin (D-(+)-Neopterin), a catabolic product of guanosine triphosphate (GTM), serves as a marker of cellular immune system activation.
N(omega)-phosphonato-L-arginine
Conjugate base of N(omega)-phospho-L-arginine having anionic carboxy and phosphate groups and protonated amino and guanidino nitrogens.
3-(1H-indol-3-yl)propyl phosphate
C11H12NO4P-2 (253.05039219999998)
5-(3-Carboxy-3-oxopropenyl)-4,6-dihydroxypicolinate
[(2R,3R,4R)-3,4,5-Trihydroxy-1-oxopentan-2-yl] (2R)-2-amino-3-sulfanylpropanoate
Daidzein(1-)
A flavonoid oxoanion obtained by deprotonation of the 7-hydroxy group of daidzein. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
4-butyl-3-(3-methyl-2-thiophenyl)-1H-1,2,4-triazole-5-thione
C11H15N3S2 (253.07073499999998)
2-[(5-Anilino-1,3,4-thiadiazol-2-yl)thio]ethanol
C10H11N3OS2 (253.03435159999998)
(2S)-2-azaniumyl-5-oxo-5-[(2-sulfonatoethyl)amino]pentanoate
5-Nitro-2-trimethylsilyloxy-acetophenone
C11H15NO4Si (253.07703099999998)
4-Nitrophenylacetic acid trimethylsilyl ester
C11H15NO4Si (253.07703099999998)
3-Nitrophenylacetic acid trimethylsilyl ester
C11H15NO4Si (253.07703099999998)
3-Cyano-8-hydroxymethyl-4-methoxymethylazulene-1-carboxylic acid lactone
tizanidine
C9H8ClN5S (253.01889179999998)
M - Musculo-skeletal system > M03 - Muscle relaxants > M03B - Muscle relaxants, centrally acting agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D002491 - Central Nervous System Agents > D000700 - Analgesics Tizanidine is an α2-adrenergic receptor agonist and inhibits neurotransmitter release from CNS noradrenergic neurons. Target: α2-adrenergic receptor Tizanidine is a drug that is used as a muscle relaxant. It is a centrally acting α2 adrenergic agonist. It is used to treat the spasms, cramping, and tightness of muscles caused by medical problems such as multiple sclerosis, ALS, spastic diplegia, back pain, or certain other injuries to the spine or central nervous system. It is also prescribed off-label for migraine headaches, as a sleep aid, and as an anticonvulsant. It is also prescribed for some symptoms of fibromyalgia. Tizanidine has been found to be as effective as other antispasmodic drugs and has superior tolerability to that of baclofen and diazepam. Tizanidine can be very strong even at the 2 mg dose and may cause hypotension, so caution is advised when it is used in patients who have a history of orthostatic hypotension, or when switching from gel cap to tablet form and vice versa. Tizanidine can occasionally cause liver damage, generally the hepatocellular type. Clinical trials show that up to 5\% of patients treated with tizanidine had elevated liver function test values, though symptoms disappeared upon withdrawal of the drug. Care should be used when first beginning treatment with tizanidine with regular liver tests for the first 6 months of treatment.
5-amino-4-chloro-2-(2,3-dihydroxyphenyl)pyridazin-3(2H)-one
D-Monapterin
C9H11N5O4 (253.08110059999998)
Neopterin (D-(+)-Neopterin), a catabolic product of guanosine triphosphate (GTM), serves as a marker of cellular immune system activation.
FUREGRELATE
C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor
D-erythro-Eritadenine
C9H11N5O4 (253.08110059999998)
D004791 - Enzyme Inhibitors
Cyclohexanone, 2-(2-chlorophenyl)-6-hydroxy-2-(methylamino)-
glutaurine(1-)
An organosulfonate oxoanion resulting from the deprotonation of the sulfonic acid moiety of glutaurine zwitterion. The major species at pH 7.3.
(S)-(-)-5-Fluorowillardiine (hydrochloride)
C7H9ClFN3O4 (253.02655959999998)
(S)-(-)-5-Fluorowillardiine hydrochloride is a potent and specific AMPAR agonist.
1,2,6-trihydroxy-3-methoxy-5-[(1e)-prop-1-en-1-yl]pyrano[3,2-b]pyrrol-7-one
1,2,6-trihydroxy-3-methoxy-5-(prop-1-en-1-yl)pyrano[3,2-b]pyrrol-7-one
(2r)-2-{[hydroxy(2-hydroxyphenyl)methylidene]amino}butanedioic acid
7-hydroxybiopterin
C9H11N5O4 (253.08110059999998)
{"Ingredient_id": "HBIN013270","Ingredient_name": "7-hydroxybiopterin","Alias": "NA","Ingredient_formula": "C9H11N5O4","Ingredient_Smile": "CC(C(C1=NC2=C(NC1=O)NC(=NC2=O)N)O)O","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9852","TCMSP_id": "NA","TCM_ID_id": "21434","PubChem_id": "NA","DrugBank_id": "NA"}
(1r,2r)-1-(4-hydroxy-2-imino-1h-pteridin-6-yl)propane-1,2,3-triol
C9H11N5O4 (253.08110059999998)
[bis(methylsulfanyl)methylidene][2-(4-methoxyphenyl)ethenyl]amine
C12H15NOS2 (253.05950199999998)
5-(3,3-dichloro-2-methylpropyl)-3,3-dimethyl-4,5-dihydropyrrole-2,4-diol
C10H17Cl2NO2 (253.06362820000004)
(4s,5s)-5-[(2r)-3,3-dichloro-2-methylpropyl]-3,3-dimethyl-4,5-dihydropyrrole-2,4-diol
C10H17Cl2NO2 (253.06362820000004)
[bis(methylsulfanyl)methylidene][(1z)-2-(4-methoxyphenyl)ethenyl]amine
C12H15NOS2 (253.05950199999998)
5-methyl-9h-[1,3]dioxolo[4,5-j]phenanthridin-6-one
(4s,5s)-5-(3,3-dichloro-2-methylpropyl)-3,3-dimethyl-4,5-dihydropyrrole-2,4-diol
C10H17Cl2NO2 (253.06362820000004)
1,3,6-trihydroxy-2-methoxy-5-(prop-1-en-1-yl)pyrano[3,2-b]pyrrol-7-one
1,3,6-trihydroxy-2-methoxy-5-[(1e)-prop-1-en-1-yl]pyrano[3,2-b]pyrrol-7-one
(1r,2s)-1-(4-hydroxy-2-imino-1h-pteridin-6-yl)propane-1,2,3-triol
C9H11N5O4 (253.08110059999998)
2-{[hydroxy(2-hydroxyphenyl)methylidene]amino}butanedioic acid
(2s)-2-{[hydroxy(2-hydroxyphenyl)methylidene]amino}butanedioic acid
[bis(methylsulfanyl)methylidene][(1e)-2-(4-methoxyphenyl)ethenyl]amine
C12H15NOS2 (253.05950199999998)
1-(4-hydroxy-2-imino-1h-pteridin-6-yl)propane-1,2,3-triol
C9H11N5O4 (253.08110059999998)