Exact Mass: 354.0399
Exact Mass Matches: 354.0399
Found 272 metabolites which its exact mass value is equals to given mass value 354.0399,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
THIODICARB
CONFIDENCE standard compound; INTERNAL_ID 457; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8163; ORIGINAL_PRECURSOR_SCAN_NO 8160 CONFIDENCE standard compound; INTERNAL_ID 457; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8215; ORIGINAL_PRECURSOR_SCAN_NO 8210 CONFIDENCE standard compound; INTERNAL_ID 457; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8251; ORIGINAL_PRECURSOR_SCAN_NO 8248 CONFIDENCE standard compound; INTERNAL_ID 457; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8269; ORIGINAL_PRECURSOR_SCAN_NO 8264
5-Amino-6-(5-phosphoribosylamino)uracil
[3-(3,4-Methylenedioxyphenyl)-2-(mercaptomethyl)-1-oxoprolyl]glycine
PHENOL RED
V - Various > V04 - Diagnostic agents > V04C - Other diagnostic agents > V04CH - Tests for renal function and ureteral injuries D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D010635 - Phenolphthaleins D004396 - Coloring Agents Same as: D01200
Chlorpromazine hydrochloride
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent > C740 - Phenothiazine D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent D005765 - Gastrointestinal Agents > D000932 - Antiemetics
Niazidin
Constituent of the fresh pods of Moringa oleifera (horseradish tree). Niazidin is found in fats and oils, herbs and spices, and green vegetables. Niazidin is a glycoside that has been isolated from the fresh pods of Moringa oleifera (horseradish tree). Niazidin is found in fats and oils.
Cyclovariegatin
Cyclovariegatin is found in mushrooms. Cyclovariegatin is isolated from sporophores of Suillus grevillei (larch bolete
3,4,5-trihydroxy-6-[(8-hydroxy-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid
2-O-p-Coumaroylhydroxycitric acid
2-O-p-Coumaroylhydroxycitric acid is found in cereals and cereal products. 2-O-p-Coumaroylhydroxycitric acid is a constituent of Zea mays (sweet corn). Constituent of Zea mays (sweet corn). 2-O-p-Coumaroylhydroxycitric acid is found in cereals and cereal products, fats and oils, and corn.
Dihydronaringenin-O-sulphate
Dihydronaringenin-O-sulphate is a conjugate of dihydronaringenin and sulphate. Dihydronaringenin, also known as phloretin, is a dihydrochalcone, a type of natural phenols. It can be found in apple tree leaves. (Wikipedia)
((2-Amino-3-((2-amino-3-((carboxymethyl)amino)-3-oxopropyl)dithio)propanoyl)amino)acetic acid
Desacetylcephalothin
Glucose lactate pyruvate
Glucose pyruvate lactate
{3,5-Dichloro-4-[4-Hydroxy-3-(Propan-2-Yl)phenoxy]phenyl}acetic Acid
THIODICARB
uric acid citrate
XIPAMIDE
C - Cardiovascular system > C03 - Diuretics > C03B - Low-ceiling diuretics, excl. thiazides > C03BA - Sulfonamides, plain D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic D045283 - Natriuretic Agents > D004232 - Diuretics
Apiforol sulfate
5-Methoxysterigmatocystin
D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
5-Hydroxy-6-methoxy-3,4-methylenedioxyfurano[2,3:7,8]flavanone
6-Desmethylcandidusin B
A member of the class of dibenzofurans that is dibenzo[b,d]furan substituted by a 3,4-dihydroxyphenyl group at position 3, hydroxy groups at positions 1, 7 and 8 and a methoxy group at position 4. It has been isolated from the culture of the mangrove endophytic fungus Penicillium chermesinum.
XIPAMIDE
C - Cardiovascular system > C03 - Diuretics > C03B - Low-ceiling diuretics, excl. thiazides > C03BA - Sulfonamides, plain D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic D045283 - Natriuretic Agents > D004232 - Diuretics
4,4,4-Trifluoro-2-(isothioureido-thiophen-3-yl-methyl)-3-oxo-butyric acid ethyl ester
6-hydroxy-7-methoxy-3,7-dicoumarinyl ether|7-methyl-edgeworthin|Rutamontine
7-hydroxy-6-[(6,7-dihydroxy-2-oxo-2H-1-benzopyran-5-yl)oxy]-2H-1-benzopyran-2-one|dimeresculetin
6-acetoxy-7-acetyl-1-hydroxy-3-methoxyanthraquinone
2,5-DICHLORO-1-HYDROXY-3,6-DIMETHOXY-8-METHYL-9H-XANTHEN-9-ONE
6-Hydroxy-12,15-dihydro-15,17-dioxo-12,12-dimethyl-17H-11,16-dioxa-11H-cyclopenta[a]phenanthrene-7-carboxylic acid methyl ester
2,4-Dichloro-1-hydroxy-3,6-dimethoxy-8-methyl-9H-xanthen-9-one
1,3-Dimethyl-2,4-dioxo-6-(methylsulfinyl)-1,2,3,4-tetrahydrothieno[3,2-g]pteridine-7-carboxylic acid
7-acetoxy-3-benzo[1,3]dioxol-5-yl-6-methoxy-chromen-4-one|7-acetoxy-6-methoxy-3,4-methylenedioxyisoflavone|7-O-acetylfujikinetin
(?)-agelastatin E|8a-O-methylagelastatin A|agelastatin E
6-Aldehydoisoophiopogonone A
6-Aldehydo-isoophiopogonone A is a natural product found in Ophiopogon japonicus with data available.
2-(1,5-dihydroxy-3,4-dioxonaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid
2-(3,5-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid
2-(1,5-dihydroxy-3,4-dioxonaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid [IIN-based: Match]
2-(3,5-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid_major
Cyclovariegatin
2-O-p-Coumaroylhydroxycitric acid
3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylic acid
Methyl 7-bromo-5-hydroxy-4,8-dimethoxy-6-methyl-2-naphthoate
2-[[4-(2-Pyridylsulfamoyl)phenyl]azo]hydroxybenzene
n,n-ethylenebis(5-hydroxysalicylideneiminato)iron(ii)
4-AMINO-1-(4-CHLORO-BENZYL)-PIPERIDINE-4-CARBOXYLIC ACID METHYL ESTERDI HYDROCHLORIDE
3,4-Dihydro-2-(3-methoxypropyl)-4-oxo-2H-thieno[3,2-e]-1,2-thiazine-6-sulfonamide 1,1-dioxide
N1,N1-DIETHYL-5-CHLORO-2-(4-CHLOROPHENOXY)-4-NITROANILINE
5,5,6,6,7,7,8,8,9,9,9-undecafluorononane-2,4-dione
Enisamium iodide
J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C254 - Anti-Infective Agent > C281 - Antiviral Agent Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3-[2-(Diaminomethyleneamino)-1,3-thiazol-4-ylmethylsulphinyl]-N-sulphamoylpropanamide
IMp. B (EP) as Dihydrochloride: N-[3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-N,N,N-triMethyl- propane-1,3-diaMine Dihydrochloride
Methyl 4-amino-1-(4-chlorobenzyl)piperidine-4-carboxylate dihydrochloride
Cys-Gly, oxidized
N-[[3-Fluoro-4-ethoxy-pyrid-2-YL]ethyl]-N-[5-chloro-pyridyl]-thiourea
2-(1,5-Dihydroxy-3,4-dioxonaphthalen-2-yl)-3-methoxy-5-methylbenzoic acid
N-(3-chloro-4-methylphenyl)-4-oxo-3,10-dihydro-2H-pyrimido[1,2-a]benzimidazole-2-carboxamide
3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(2-methoxyethyl)prop-2-enamide
4-(2-Chlorophenyl)-8-(2-Hydroxyethyl)-6-Methylpyrrolo[3,4-E]indole-1,3(2h,6h)-Dione
2-[Carboxy-(2-thiophen-2-YL-acetylamino)-methyl]-5-methylene-5,6-dihydro-2H-[1,3]thiazine-4-carboxylic acid
3-hydroxy-2-(1,2,2-trihydroxyethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2H-furan-5-one
[5-[(5-amino-2,4-dioxo-1H-pyrimidin-6-yl)amino]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
3,4,5-Trihydroxy-6-(8-hydroxy-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid
(4S,8R)-2,20-dihydroxy-7,9,13-trioxapentacyclo[10.9.0.03,10.04,8.015,20]henicosa-1,3(10),5,11,15,17-hexaene-14,19,21-trione
3,7,8,10-Tetrahydroxy-1-methylbenzo[b]xanthene-6,11,12-trione
2-Hydroxypropanoyl 2-oxo-3-[2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]propaneperoxoate
2-Oxopropanoyl 2-hydroxy-2-[2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]propaneperoxoate
(2S,5R)-7-chloro-3,4,6-trimethoxy-5-methylspiro[benzofuran-2,4-cyclohexane]-1,3-dione
2-(2,4-dichlorophenoxy)-N-(4-methyl-2-nitrophenyl)acetamide
4-methyl-N-[(1Z)-3-oxo-3-thien-2-yl-1-(trifluoromethyl)propylidene]benzohydrazide
3-methoxy-N-[[(2-oxo-1-benzopyran-6-yl)amino]-sulfanylidenemethyl]benzamide
4-bromo-N-[(E)-quinoxalin-6-ylmethylidene]benzohydrazide
1-mercapto-4-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
2-bromo-N-[[(2-methylcyclohexyl)amino]-sulfanylidenemethyl]benzamide
3-[[(2,4-Dichloroanilino)-sulfanylidenemethyl]amino]-4-methylbenzoic acid
N-(1,1-dioxo-3-thiolanyl)-N-ethyl-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)acetamide
O-cyano N-[[4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyphenyl]methyl]carbamothioate
3-(2,3-Dihydro-1,4-benzodioxin-3-yl)-6-(4-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
1-amino-2-(4-bromophenyl)-4,5-dihydro-3aH-pyrrolo[1,2-a]quinolin-3-one
3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine;hydron;chloride
Ethyl 2-[3-cyano-4-(uran-2-yl)-6-thiophen-2-ylpyridin-2-yl]oxyacetate
11-hydroxy-O-methylsterigmatocystin
A sterigmatocystin that is the 11-hydroxy-8-O-methyl derivative of the parent sterigmatocystin.
2,2-{Disulfanediylbis[(2-azaniumyl-1-oxopropane-3,1-diyl)azanediyl]}diacetate
(1R,2S)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropane-1,2,3-tricarboxylic acid
2-(3-Methoxybenzyl)-5-[5-(2-thienyl)-2-thienyl]-1,3,4-oxadiazole
(2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(chloromethyl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate
1-(5-O-Phosphono-beta-D-ribofuranosyl)-5-amino-1H-imidazole-4-carbothioamide
(1R,5S)-3-[2-chloro-4-(methylsulfonyl)benzoyl]-4-hydroxybicyclo[3.2.1]oct-3-en-2-one
[3-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)phenyl] hydrogen sulate
{4-[1-Oxo-1-(2,4,6-trihydroxyphenyl)propan-2-yl]phenyl}oxidanesulfonic acid
[4-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)phenyl] hydrogen sulate
(2-benzyl-2,4,6-trihydroxy-3H-1-benzouran-3-yl) hydrogen sulate
3-[2-Chloro-4-(methylsulfonyl)benzoyl]-4-hydroxybicyclo[3.2.1]oct-3-en-2-one
2-(heptafluoropropyl)-6-(trifluoromethyl)-1H-benzimidazole
5-amino-6-(5-phospho-beta-D-ribosylamino)uracil
An N-glycosyl compound that consists of 5,6-diaminouracil in which one of the hydrogens on the 6-amino function is substituted by a 5-phospho-beta-D-ribosyl residue.
5-(3-(2,6-Dichloro-4-(4,5-Dihydro-2-Oxazolyl)phenoxy)propyl)-3-Methyl Isoxazole
2,4-dichlorolichexanthone
A member of the class of xanthones that is 9H-xanthen-9-one substituted by a hydroxy group at positions 1, chloro groups at positions 2 and 4, methoxy groups at positions 3 and 6 and a methyl group at position 8.
S-(chloromethyl)glutathione(1-)
A peptide anion obtained by deprotonation of both carboxy groups and protonation of the glutamyl amino group of S-(chloromethyl)glutathione; major species at pH 7.3.
5-Amino-6-(5-phosphoribitylamino)uracil(2-)
Dianion of 5-amino-6-(5-phosphoribitylamino)uracil arising from deprotonation of both phosphate OH groups.
5-BDBD
5-BDBD, a potent and selective P2X4 receptor antagonist, inhibits rP2X4R-mediated currents, with an IC50 of 0.75 μM. 5-BDBD completely blocks the basal and acute hyperalgesia induced by nitroglycerin (NTG)[1][2].
Olutasidenib
Olutasidenib (FT-2102) is a highly potent, orally active, brain penetrant and selective inhibitor of mutant Isocitrate dehydrogenase 1 (IDH1), with IC50 values of 21.2 nM and 114 nM for IDH1- R132H and IDH1- R132C, respectively . Olutasidenib (FT-2102) is under the study in the treatment of acute myeloid leukemia (AML) or myelodysplastic syndrome (MDS) [1][2].
15-hydroxy-11,18-dimethoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,4,9,11,14,16,18-heptaen-13-one
3-[(6-carboxy-3,4-dihydroxyoxan-2-yl)oxy]-4,5,6-trihydroxyoxane-2-carboxylic acid
1-(7-bromo-8-ethyl-3,6,7,8-tetrahydro-2h-oxocin-2-yl)hex-3-en-5-yn-1-yl acetate
(12r)-12-(2h-1,3-benzodioxol-5-yl)-8-hydroxy-7-methoxy-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1,3,6,8-tetraen-10-one
1-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}propane-1,2,3-tricarboxylic acid
3-acetyl-5-hydroxy-7-methoxy-9,10-dioxoanthracen-2-yl acetate
1-(cyanooxy)-n-[(4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)methyl]methanimidothioic acid
(2r,3r,5r)-5-[(1s,3e)-1-bromohex-3-en-1-yl]-2-[(2z)-pent-2-en-4-yn-1-yl]oxolan-3-yl acetate
(16s,17s,18r)-8,11,16,17,18-pentahydroxy-16-methyl-13,14-diazapentacyclo[10.6.1.0²,¹⁰.0⁴,⁹.0¹⁵,¹⁹]nonadeca-1(19),2(10),4,6,8,11,14-heptaen-3-one
3,11-dihydro-5-hydroxy-11,11-dimethyl-1,3-dioxo-1h-furo[3,4-d]naphtho[1,2-b]pyran-4-carboxylic acid,9ci; me ester
{"Ingredient_id": "HBIN006896","Ingredient_name": "3,11-dihydro-5-hydroxy-11,11-dimethyl-1,3-dioxo-1h-furo[3,4-d]naphtho[1,2-b]pyran-4-carboxylic acid,9ci; me ester","Alias": "NA","Ingredient_formula": "C19H14O7","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8469","PubChem_id": "NA","DrugBank_id": "NA"}
6-aldehydoisoophiopogone a
{"Ingredient_id": "HBIN012178","Ingredient_name": "6-aldehydoisoophiopogone a","Alias": "6-aldehydo-isoophiopogone a","Ingredient_formula": "C19H14O7","Ingredient_Smile": "CC1=C(C(=C(C2=C1OC=C(C2=O)CC3=CC4=C(C=C3)OCO4)O)C=O)O","Ingredient_weight": "354.315","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "875","TCMSP_id": "NA","TCM_ID_id": "7584","PubChem_id": "NA","DrugBank_id": "NA"}
6-aldehydo-isoophipogonone a
{"Ingredient_id": "HBIN012180","Ingredient_name": "6-aldehydo-isoophipogonone a","Alias": "NA","Ingredient_formula": "C19H14O7","Ingredient_Smile": "CC1=C(C(=C(C2=C1OC=C(C2=O)CC3=CC4=C(C=C3)OCO4)O)C=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "25804","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,8-dihydroxycoumarin-7-o-β-d-glucuronide
{"Ingredient_id": "HBIN012984","Ingredient_name": "7,8-dihydroxycoumarin-7-o-\u03b2-d-glucuronide","Alias": "NA","Ingredient_formula": "C15H14O10","Ingredient_Smile": "C1=CC(=C(C2=C1C=CC(=O)O2)O)OC3C(C(C(C(O3)C(=O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5796","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anadanthoflavone
{"Ingredient_id": "HBIN015971","Ingredient_name": "anadanthoflavone","Alias": "NA","Ingredient_formula": "C19H14O7","Ingredient_Smile": "COC(=O)C=CC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)O)O","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1131","TCMSP_id": "NA","TCM_ID_id": "10065;10066;10067;10068","PubChem_id": "NA","DrugBank_id": "NA"}
