Exact Mass: 364.0253
Exact Mass Matches: 364.0253
Found 233 metabolites which its exact mass value is equals to given mass value 364.0253,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
6-Thioinosine-5'-monophosphate
6-Thioinosine-5-monophosphate is a metabolite of mercaptopurine. Mercaptopurine (also called 6-mercaptopurine, 6-MP or its brand name Purinethol) is an immunosuppressive drug. It is a thiopurine. (Wikipedia)
Xanthylic acid
Xanthylic acid, also known as xmp or (9-D-ribosylxanthine)-5-phosphate, is a member of the class of compounds known as purine ribonucleoside monophosphates. Purine ribonucleoside monophosphates are nucleotides consisting of a purine base linked to a ribose to which one monophosphate group is attached. Xanthylic acid is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Xanthylic acid can be found in a number of food items such as common grape, black-eyed pea, java plum, and wild rice, which makes xanthylic acid a potential biomarker for the consumption of these food products. Xanthylic acid exists in all living species, ranging from bacteria to humans. In humans, xanthylic acid is involved in several metabolic pathways, some of which include azathioprine action pathway, glutamate metabolism, mercaptopurine action pathway, and purine metabolism. Xanthylic acid is also involved in several metabolic disorders, some of which include purine nucleoside phosphorylase deficiency, succinic semialdehyde dehydrogenase deficiency, xanthine dehydrogenase deficiency (xanthinuria), and molybdenum cofactor deficiency. Xanthosine monophosphate is an intermediate in purine metabolism. It is a ribonucleoside monophosphate. It is formed from IMP via the action of IMP dehydrogenase, and it forms GMP via the action of GMP synthaseand is) also, XMP can be released from XTP by enzyme deoxyribonucleoside triphosphate pyrophosphohydrolase containing (d)XTPase activity . Xanthylic acid is an important metabolic intermediate in the Purine Metabolism, and is a product or substrate of the enzymes Inosine monophosphate dehydrogenase (EC 1.1.1.205), Hypoxanthine phosphoribosyltransferase (EC 2.4.2.8), Xanthine phosphoribosyltransferase (EC 2.4.2.22), 5-Ribonucleotide phosphohydrolase (EC 3.1.3.5), Ap4A hydrolase (EC 3.6.1.17), Nucleoside-triphosphate diphosphatase (EC 3.6.1.19), Phosphoribosylamine-glycine ligase (EC 6.3.4.1), and glutamine amidotransferase (EC 6.3.5.2). (KEGG) Xanthylic acid can also be used in quantitative measurements of the Inosine monophosphate dehydrogenase enzyme activities in purine metabolism. This measurement is important for optimal thiopurine therapy for children with acute lymphoblastic leukaemia (ALL). (PMID: 16725387). Acquisition and generation of the data is financially supported in part by CREST/JST. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Fertilysin
Win 18446 is an orally active testes-specific enzyme ALDH1a2 inhibitor, with an IC50 of 0.3 μM. Win 18446 reversibly inhibits spermatogenesis in many species and inhibits Retinoic acid (HY-14649) biosynthesis from Retinol (HY-B1342) within the testes[1][2].
Glucose isomerase from streptomyces rubiginosus
Glucose isomerase from streptomyces rubiginosus is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
5'-xanthylate(2-)
5-xanthylate(2-) is also known as 5-Xanthylate dianion or XMP. 5-xanthylate(2-) is considered to be slightly soluble (in water) and acidic
(1Ar,2Z,4E,14R,15aR)-8-chloro-9,11-dihydroxy-14-methyl-15,15a-dihydro-1aH-benzo[c]oxireno[2,3-k][1]oxacyclotetradecine-6,12(7H,14H)-dione
Fertilysin
Win 18446 is an orally active testes-specific enzyme ALDH1a2 inhibitor, with an IC50 of 0.3 μM. Win 18446 reversibly inhibits spermatogenesis in many species and inhibits Retinoic acid (HY-14649) biosynthesis from Retinol (HY-B1342) within the testes[1][2].
Indacrinone
D018501 - Antirheumatic Agents > D006074 - Gout Suppressants > D014528 - Uricosuric Agents C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D045283 - Natriuretic Agents > D004232 - Diuretics
o-(pentafluorobenzyloxycarbonyl)-benzoyl chloride
o-(pentafluorobenzyloxycarbonyl)benzoyl chloride
thioinosine monophosphate
radicicol
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D004791 - Enzyme Inhibitors An antifungal macrolactone antibiotic, obtained from Diheterospora chlamydosporia and Chaetomium chiversii that inhibits protein tyrosine kinase and heat shock protein 90 (Hsp90). C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C254 - Anti-Infective Agent > C514 - Antifungal Agent
Dehydropachyrrhizone
Perfluoroheptanoic acid
CONFIDENCE standard compound; INTERNAL_ID 5947 CONFIDENCE standard compound; INTERNAL_ID 2410 CONFIDENCE standard compound; EAWAG_UCHEM_ID 2716
2,3,4a,8a-Tetrahydro-5-hydroxy-2,3:4a,8a-diepoxyspiro[naphtho[1,8-de]-1,3-dioxin-2,1(4H)-naphthalene]-4,8(5H)-dione
O1-(2-amino-4-sulfamoyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2-Amino-4-sulfamoyl-phenyl)-beta-D-glucopyranuronsaeure
((2R,3R,4S,5R)-5-(2,6-dioxo-1,2,3,6-tetrahydropurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl)methyl hydrogen sulfate
O1-(4-amino-2-sulfamoyl-phenyl)-beta-D-glucopyranuronic acid|O1-(4-Amino-2-sulfamoyl-phenyl)-beta-D-glucopyranuronsaeure
2-chloro-3,8-dihydroxy-1,6-dimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-7-carboxylic acid methyl ester|3-Dechlor-lecideoidin|3-Dechlorolecideoidin|dechlorolecideoidin
2,4,5-trihydroxy-3-(4,6,7-trihydroxy-3-oxo-1,3-dihydroisobenzofuran-5-yl)-benzoic acid methyl ester
N-Methyl-2-[4-(3-aminopropoxy)-3,5-dibromophenyl]ethylamine
Thioinosinic acid
[Raw Data] CB244_Thioinosinic-acid_pos_50eV_CB000084.txt [Raw Data] CB244_Thioinosinic-acid_pos_40eV_CB000084.txt [Raw Data] CB244_Thioinosinic-acid_pos_30eV_CB000084.txt [Raw Data] CB244_Thioinosinic-acid_pos_20eV_CB000084.txt [Raw Data] CB244_Thioinosinic-acid_pos_10eV_CB000084.txt
C18H17ClO6_(1aS,2Z,4E,14R,15aS)-8-Chloro-9,11-dihydroxy-14-methyl-1a,14,15,15a-tetrahydro-6H-oxireno[e][2]benzoxacyclotetradecine-6,12(7H)-dione
(4R,6S,8S,9Z,11E)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.0⁶,⁸]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione
(4R,6S,8S,9Z,11E)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.0⁶,⁸]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione_74.5\\%
(4R,6S,8S,9Z,11E)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.0⁶,⁸]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione_major
(4R,6S,8S,9Z,11E)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.0?,?]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione
Glucose isomerase from streptomyces rubiginosus
methyl 5-chloro-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine-3-carboxylate
Benzenesulfonic acid,4-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-3-methyl-, sodium salt (1:1)
5,6-Dichloro-1-ethyl-2-methyl-3-(3-sulfobutyl)benzimidazolium inner salt
n-(2-bromophenyl)-n-(1,2-diphenylethylidene)hydrazine
4-[(3,4-dichlorophenyl)methyl]-2,3-dihydro-1H-quinoxaline
tert-butyl 5-bromo-3-(trifluoromethyl)indazole-1-carboxylate
Benzenemethanol,2,3,4,5,6-pentafluoro-a-(2,3,4,5,6-pentafluorophenyl)-
6-METHYL-5-(4-PHENYL-1,3-THIAZOL-2-YL)-2-(TRIFLUOROMETHYL)NICOTINIC ACID
ethyl 7-chloro-6-fluoro-1-(4-fluorophenyl)-4-oxo-1,8-naphthyridine-3-carboxylate
2-(3-Chloro-5-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
5-(3-Iodo-1H-pyrrolo[2,3-b]pyridin-5-yl)-N,N-dimethyl-2-pyridinam ine
sodium,5-methyl-2-[(2Z)-2-(2-oxonaphthalen-1-ylidene)hydrazinyl]benzenesulfonate
1H-PYRROLO[2,3-B]PYRIDINE, 3-BROMO-5-METHYL-1-[(4-METHYLPHENYL)SULFONYL]-
Thiazolidine, 2-(4-methylphenyl)-3-[(3-nitrophenyl)sulfonyl]- (9CI)
Thiazolidine, 2-(4-methylphenyl)-3-[(4-nitrophenyl)sulfonyl]- (9CI)
1-(2-chloroethyl)-4-[3-(trifluoromethyl)phenyl]piperazine,dihydrochloride
1-(4-Amino-3,5-dibromophenyl)-2-(tert-butylamino)ethanol
2-bromomethyl-4-trifluoromethylbenzene boronic ester
5-(4-CYANO-BENZOYLAMINO)-2-ETHOXY-BENZENESULFONYL CHLORIDE
Nucleocidin
A nucleoside antibiotic that is 5-O-sulfamoyladenosine in which the hydrogen atom at position 4 is replaced by a fluorine atom. It is a natural product synthesized by several Streptomyces species. It exhibits broad spectrum antibacterial activity, and also has a strong effect against Trypanosoma brucei, the protozoan parasite responsible for the African sleeping sickness.
2-chloro-1-[5-(3,4-dimethoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
4-chloro-N-[3-cyano-4-(phenylthio)phenyl]benzamide
5-(4-Bromophenyl)-2-phenylpyrazolo[1,5-a]pyrimidin-7-amine
3-Cyano-6-(3-methoxyphenyl)-2-pyridinyl 4-chlorobenzenecarboxylate
5-chloro-4-(4-methylphenyl)sulfonyl-N-phenyl-2-thiazolamine
4-[1-[(3,4-Dichlorophenyl)methylamino]propylidene]-2-(2-furanyl)-5-oxazolone
8-Chloro-10-[3-(dimethylamino)-2-hydroxypropyl]phenothiazine-2,3-dione
(5-Chloro-2-{[(3-Nitrobenzyl)amino]carbonyl}phenoxy)acetic Acid
2-{[N-(2-Acetyl-5-chloro-4-fluorophenyl)glycyl]amino}benzoic acid
Indacrinone
D018501 - Antirheumatic Agents > D006074 - Gout Suppressants > D014528 - Uricosuric Agents C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D045283 - Natriuretic Agents > D004232 - Diuretics
4-hydroxy-1,5,6-trimethyl-2,2-dioxo-N-phenylthieno[2,3-c]thiazine-3-carboxamide
5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-)
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Hercynylselenocysteine
A L-histidine derivative which is an intermediate in the synthesis of selenoneine, a compound found in certain fungi and mycobacteria.
[3-hydroxy-5-(6-oxo-1H-purin-9-yl)-4-sulfanyloxolan-2-yl]methyl dihydrogen phosphate
(4R,6S,8S,9E,11Z)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.06,8]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D004791 - Enzyme Inhibitors
1-(4-Bromophenyl)-3-[2-(2-methoxyphenoxy)ethyl]urea
3,3-Dimethyl-1-[[9-(methylthio)-5,6-dihydrothieno[3,4-h]quinazolin-2-yl]thio]-2-butanone
N-(1,3-benzodioxol-5-yl)-6-chloro-2-(2-pyridinyl)-3-imidazo[1,2-a]pyridinamine
3-chloro-N-[3-(1-imidazolyl)propyl]-6-nitro-1-benzothiophene-2-carboxamide
2-(6-Amino-5-cyano-3-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoic acid
(E)-3-(2-chlorophenyl)-N-[4-(dimethylsulfamoyl)phenyl]prop-2-enamide
N-(3-chlorophenyl)-2-[[2-(2-pyridinyl)-2,3-dihydro-1,3,4-thiadiazol-5-yl]thio]acetamide
4-(4-Bromophenyl)-2-(3,5-dimethyl-1-pyrazolyl)-4-oxobutanoic acid methyl ester
methyl N-[(E)-[3-[2-(4-chlorophenyl)sulfanylethoxy]phenyl]methylideneamino]carbamate
2-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-furanylmethyl)acetamide
N,N-diethyl-2-[(3-thiophen-2-yl-7-isothiazolo[4,5-d]pyrimidinyl)thio]acetamide
4-(4-chlorophenyl)-N-(3-pyridinylmethyl)-6-(trifluoromethyl)-2-pyrimidinamine
1-[2-[[5-(2-Methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]-2-pyrrolidinone
N-[[3-(2-oxazolo[4,5-b]pyridinyl)anilino]-sulfanylidenemethyl]-2-furancarboxamide
N-[2-(4-bromo-2-methylphenoxy)-1-oxoethyl]-2-pyrazinecarbohydrazide
2-Chloro-5-[[[[(3-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid
(2S)-3-(2-{[(2R)-2-amino-2-carboxyethyl]selanyl}-1H-imidazol-4-yl)-2-(trimethylazaniumyl)propanoate
N-(2,6-dimethylphenyl)-1-methyl-2,2,4-trioxo-3-thieno[3,2-c]thiazinecarboxamide
1,5,6-trimethyl-2,2,4-trioxo-N-phenyl-3-thieno[2,3-c]thiazinecarboxamide
4-bromo-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]benzenesulfonamide
[5-(7-Hydroxy-4-oxochromen-2-yl)-2-methoxyphenyl] hydrogen sulate
(4R,6S,8S,9Z,11E)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.06,8]nonadeca-1(15),9,11,16,18-pentaene-2,13-dione
5-xanthylic acid
A purine ribonucleoside 5-monophosphate having xanthine as the nucleobase. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
hercynylselenocysteine zwitterion
An L-alpha-amino acid zwitterion formed from hercynylselenocysteine by transfer of a proton from the carboxy to the amino group; major species at pH 7.3.
5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-)
Dianion of 5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide.
NS 1738
NS 1738 (NSC 213859) is a novel positive allosteric modulator of the α7 nAChR, with respect to positive modulation of α7 nAChR (EC50=3.4 μM in oocyte experiments).
VPC-70619
VPC-70619 is a potent, orally active N-Myc inhibitor. VPC-70619 blocks the N-Myc-Max heterocomplex from binding to DNA E-boxes and demonstrated strong inhibition activity against N-Myc-dependent cell lines as well as high bioavailability in both oral and intraperitoneal administration[1].
(8-hydroxy-6-methoxy-3-methyl-9,10-dioxoanthracen-2-yl)oxidanesulfonic acid
7-bromo-6-hydroxy-1-isopropyl-3a,8-dimethyl-1h,2h,3h,9bh-cyclopenta[a]naphthalene-4,5-dione
(1s,2r,3s,5s,18r,20s)-1,8,15-trihydroxy-4,19-dioxaheptacyclo[10.8.1.1²,⁷.0³,⁵.0¹⁶,²¹.0¹⁸,²⁰.0¹¹,²²]docosa-7,9,11(22),12(21),13,15-hexaene-6,17-dione
1-{6-bromo-9h-pyrido[3,4-b]indol-1-yl}-2-phenylethanone
(3r,4s)-3,7,14-trihydroxy-16-oxo-5-oxapentacyclo[9.7.1.1²,⁶.0¹⁵,¹⁹.0¹⁰,²⁰]icosa-1,6,8,10(20),11(19),12,14,17-octaene-4-carboxylic acid
n-[(4r)-4-(5-bromo-1-methoxyindol-3-yl)-3,4,5,6-tetrahydropyrimidin-2-yl]ethanimidic acid
16-(2h-1,3-benzodioxol-5-yl)-14-hydroxy-3,5,13-trioxatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,10,15-pentaen-12-one
2,7,17-trihydroxy-20-oxahexacyclo[9.8.1.1²,¹⁰.0¹,¹¹.0³,⁸.0¹³,¹⁸]henicosa-3,5,7,13,15,17-hexaene-9,12,19-trione
(4s,6s,8s,9z,11e)-16-chloro-17,19-dihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.0⁶,⁸]nonadeca-1(19),9,11,15,17-pentaene-2,13-dione
methyl 1,2,3,4,6,7,8-heptahydroxy-10-oxo-9h-anthracene-9-carboxylate
10-(2h-1,3-benzodioxol-5-yl)-16-hydroxy-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8,10,15-pentaen-12-one
methyl 2,4,5-trihydroxy-3-(4,6,7-trihydroxy-3-oxo-1h-2-benzofuran-5-yl)benzoate
2-chlorosamaderine a
{"Ingredient_id": "HBIN005459","Ingredient_name": "2-chlorosamaderine a","Alias": "NA","Ingredient_formula": "C18H17ClO6","Ingredient_Smile": "CC1=C(C(=O)C2(C1=CC(=O)C34C2C(C5C(C3C(=O)O5)(OC4)C)O)C)Cl","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3571","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
