Exact Mass: 320.1048536
Exact Mass Matches: 320.1048536
Found 500 metabolites which its exact mass value is equals to given mass value 320.1048536,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Coptisine
C19H14NO4+ (320.09227840000005)
Coptisine is an alkaloid. It has a role as a metabolite. Coptisine is a natural product found in Fumaria capreolata, Fumaria muralis, and other organisms with data available. See also: Sanguinaria canadensis root (part of); Chelidonium majus flowering top (part of). A natural product found in Coptis japonica.
Mycophenolic acid
Mycophenolic acid is an an immunosuppresant drug and potent anti-proliferative, and can be used in place of the older anti-proliferative azathioprine. It is usually used as part of triple therapy including a calcineurin inhibitor (ciclosporin or tacrolimus) and prednisolone. It is also useful in research for the selection of animal cells that express the E. coli gene coding for XGPRT (xanthine guanine phosphoribosyltransferase). L - Antineoplastic and immunomodulating agents > L04 - Immunosuppressants > L04A - Immunosuppressants > L04AA - Selective immunosuppressants D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D000995 - Antitubercular Agents C471 - Enzyme Inhibitor > C2087 - Inosine Monophosphate Dehydrogenase Inhibitor C308 - Immunotherapeutic Agent > C574 - Immunosuppressant CONFIDENCE standard compound; INTERNAL_ID 8577 CONFIDENCE standard compound; INTERNAL_ID 2698 CONFIDENCE standard compound; INTERNAL_ID 4128 COVID info from COVID-19 Disease Map D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Mycophenolic acid is a potent uncompetitive inosine monophosphate dehydrogenase (IMPDH) inhibitor with an EC50 of 0.24 μM.?Mycophenolic acid demonstrates antiviral effects against a wide range of RNA viruses including influenza. Mycophenolic acid is an immunosuppressive agent. Antiangiogenic and antitumor effects[1][2].
Phenolphthalin
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D010635 - Phenolphthaleins CONFIDENCE standard compound; INTERNAL_ID 1288; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3788; ORIGINAL_PRECURSOR_SCAN_NO 3786 CONFIDENCE standard compound; INTERNAL_ID 1288; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3838; ORIGINAL_PRECURSOR_SCAN_NO 3835 CONFIDENCE standard compound; INTERNAL_ID 1288; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3790; ORIGINAL_PRECURSOR_SCAN_NO 3789 CONFIDENCE standard compound; INTERNAL_ID 1288; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3797; ORIGINAL_PRECURSOR_SCAN_NO 3795 CONFIDENCE standard compound; INTERNAL_ID 1288; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3856; ORIGINAL_PRECURSOR_SCAN_NO 3855 CONFIDENCE standard compound; INTERNAL_ID 1288; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3849; ORIGINAL_PRECURSOR_SCAN_NO 3846
Alangimarine
A member of the class of isoquinolinonaphthyridines that is 5,6-dihydroisoquinolino[2,1-b][2,7]naphthyridin-8-one bearing additional hydroxy, methoxy and vinyl substituents at positions 2, 3 and 12 respectively.
Isomugineic acid
Mugineic acid is found in barley. Excreted from the roots of barley (Hordeum vulgare), also in root-washings of oat and ric Isolated from roots of barley (Hordeum vulgare). Isomugineic acid is found in barley and cereals and cereal products.
Articaine HCl
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
N-[(Z)-(5-methylfuran-2-yl)methylideneamino]-2-phenoxybenzamide
Oleacein
Constituent of Olea europaea (olive)and is) also from Jasminum grandiflorum (Royal jasmine). Oleacein is found in many foods, some of which are green vegetables, tea, herbs and spices, and olive. Oleacein is found in fats and oils. Oleacein is a constituent of Olea europaea (olive). Also from Jasminum grandiflorum (Royal jasmine).
2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one
2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is found in fruits. 2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is a constituent of Musa acuminata (dwarf banana) infected with Colletotrichum musae. Constituent of Musa acuminata (dwarf banana) infected with Colletotrichum musae. 2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is found in fruits.
7-Hydroxy-6-methoxy-alpha-pyrufuran
7-Hydroxy-6-methoxy-alpha-pyrufuran is found in fruits. 7-Hydroxy-6-methoxy-alpha-pyrufuran is a constituent of the sapwood of Mespilus germanica (European medlar). Constituent of the sapwood of Mespilus germanica (European medlar). 7-Hydroxy-6-methoxy-alpha-pyrufuran is found in fruits.
Helipyrone
Helipyrone is found in herbs and spices. Helipyrone is a constituent of Helichrysum italicum (curry plant)
3-p-Coumaroyl-1,5-quinolactone
3-p-Coumaroyl-1,5-quinolactone is a polyphenol compound found in foods of plant origin (PMID: 20428313)
4-p-Coumaroyl-1,5-quinolactone
4-p-Coumaroyl-1,5-quinolactone is a polyphenol compound found in foods of plant origin (PMID: 20428313)
D-Fructosazine
D-Fructosazine is present in ammonia caramels and soy sauce. Present in ammonia caramels and soy sauce
(2S,3S,4R,5R)-5-(6-Aminopurin-9-yl)-N-cyclopropyl-3,4-dihydroxyoxolane-2-carboxamide
N(4)-Acetylsulfamethazine
D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid
(S)-4-(2,4-Difluoro-5-(pyrimidin-5-yl)phenyl)-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
C15H14F2N4S (320.09071880000005)
N-Acetylsulfamethazine
D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
(2S,3S,4S,5S)-2-(5-Amino-7-methyl-2,6,7,9,11-pentazatricyclo[6.3.1.04,12]dodeca-1(12),3,5,8,10-pentaen-2-yl)-5-(hydroxymethyl)oxolane-3,4-diol
4'-Methylepigallocatechin
A polyphenol metabolite detected in biological fluids [PhenolExplorer]
4-coumaroylshikimate
4-coumaroylshikimate is practically insoluble (in water) and a weakly acidic compound (based on its pKa). 4-coumaroylshikimate can be found in a number of food items such as arctic blackberry, spinach, prickly pear, and java plum, which makes 4-coumaroylshikimate a potential biomarker for the consumption of these food products.
Corylin
Corylin is a natural product found in Ulex airensis, Erythrina sacleuxii, and other organisms with data available. Corylin is an important bioactive compound isolated from psoralen; an antibiotic or anticancer compound. Corylin is an important bioactive compound isolated from psoralen; an antibiotic or anticancer compound.
[9S-(9R*,10E,11aS*)]-9-(acetyloxy)-5,6,9,11a-tetrahydro-3-(hydroxymethyl)-10-methyl-6-methylenecyclodeca[b]furan-2,7(4H,8H)-dione
Artemexifolin
(+)-Rubiginone B2; X-14881C; 8-O-Methyl-ochramycinone
3,4-Dihydrospiro[naphthalene-1(2H),2-naphtho[1,8-de][1,3]dioxin]-4,5-diol
2-hydroxy-6-hydroxymethyl-4-methoxy-3-(2,4-octadienoyl)benzoic acid
5,6,7-TRIMETHOXY-8-(3-METHYL-2-OXOBUTYL)CHROMEN-2-ONE
4-benzoyloxymethyl-3,8-dioxatricyclo[5.1.0.02,4]octane-5,6-diol 5-acetate
2-Carboxy-alpha-[(3-carboxy-3-hydroxypropyl)amino]-beta-hydroxy-1-azetidinebutanoic acid
cis-2-(3,4-dihydroxy-5-methoxyphenyl)-3,4-dihydro-2H-1-Benzopyran-3,5,7-triol
Gallocatechin 4-methyl ether
Ourateacatechin
N4-acetylsulfamethazine
A sulfonamide that is benzenesulfonamide substituted by an acetylamino group at position 4 and a 4,6-dimethyl-pyrimidin-2-yl group at the nitrogen atom. It is a metabolite of the antibiotic sulfamethazine. D000890 - Anti-Infective Agents > D013424 - Sulfanilamides CONFIDENCE standard compound; EAWAG_UCHEM_ID 247 EAWAG_UCHEM_ID 247; CONFIDENCE standard compound CONFIDENCE standard compound; INTERNAL_ID 2012
barceloneic acid A
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
(3Z,6Z)-3-[(4-Methoxyphenyl)methylene]-6-(phenylmethylene)-2,5-piperazinedione
(-)-2,3-cis-3,4-cis-4-methoxy-3,3,4,7,8-pentahydroxyflavan
t-butyl 3-[(1-methylthiopropyl)thio]-2-propenyl malonate
3,5,7,3,5-Pentahydroxy-4-methoxy-(-)-epicatechin (richtig aber: 5-Hydroxy-(-)-epicatechin-4-methylaether)|(-)-4-methylepigallocatechin|4-O-methyl-(-)-epigallocatechin|4-O-methyl-epigallocatechin|4-O-methylepigallocatechin|Ourateacatechin
7-methoxy-6-[1,4-dihydro-3-methyl-3-methoxy-2-hydroxy-4-oxo-1-furanyl]coumarin|micromeloside B
(3R*,4R*)-3-(3,4-dihydroxybenzyl)-3,4,7,8-tetrahydroxychroman|epihaematoxylol
7-Hexanoyl-2,5,7,8-tetrahydroxy-1,4-naphthoquinone
2,3-Dihydro-3,9-dihydroxy-4-phenyl-5-methoxy-1H-phenalene-1-one
1,4,8-Trihydroxy-3-methyl-9-oxo-3,4-dihydro-2H-xanthene-4a(9H)-carboxylic acid methyl ester
3-(4-hydroxyphenyl)-2,3-dihydroxy-1-(4,6-dihydroxy-2-methoxyphenyl)-1-propanone|7-3028/6
(1R,3S)-5,10-dihydroxy-1-methyl-6,9-dioxo-3,4,6,7,8,9-hexahydro-1H-naphtho[2,3-c]pyran-3-yl acetic acid
2-(3,4-dihydroxy-phenyl)-7-methoxy-chroman-3,4,5-triol
7-methoxy-8-(1S*,3-dihydroxy-2S*-acetyl-3-butenyl)coumarin|omphalocarpinol
5-Hydroxy-6,6-dimethylpyrano<2,3:7,6>flavon|5-hydroxy-6,6-dimethylpyrano<3,2:6,7>flavone|5-Hydroxy-8,8-dimethyl-2-phenyl-2H,6H-benzo[1,2-b:5,4-b]dipyran-6-one,9CI|5-hydroxy-8,8-dimethyl-2-phenyl-8H-pyrano[3,2-g]chromen-4-one
8-Me ether-(2R,3S,4S)-3,3,4,4,7,8-Hexahydroxyflavan
1-N-beta-D-ribofuranosyldamirone C|N-1-beta-D-ribofuranosyldamirone C
alpha-Amino-beta-hydroxy-4,6-dimethyl-9-oxo-4,9-dihydro-1H-imidazo[1,2-a]purine-7-butanoic acid
2-(2-Methyl-2-propenoyl),2-Ac,Me ester-2-Hydroxy-5-(hydroxyacetyl)benzoic acid|caleteucrifolone
(E)-2,5-dihydroxy-7-methoxy-3-methoxymethylene-2-(2-oxopropyl)-2,3-dihydro[1,4]naphthoquinone|ascomycone C
2-hydroxy-6-[2-hydroxy-6-(hydroxymethyl)-4-methoxyphenoxy]-4-methylbenzoic acid
Ala Ala Cys Gly
C11H20N4O5S (320.11543500000005)
Ala Ala Gly Cys
C11H20N4O5S (320.11543500000005)
Ala Cys Ala Gly
C11H20N4O5S (320.11543500000005)
Ala Cys Gly Ala
C11H20N4O5S (320.11543500000005)
Ala Gly Ala Cys
C11H20N4O5S (320.11543500000005)
Ala Gly Cys Ala
C11H20N4O5S (320.11543500000005)
Cys Ala Ala Gly
C11H20N4O5S (320.11543500000005)
Cys Ala Gly Ala
C11H20N4O5S (320.11543500000005)
Cys Gly Ala Ala
C11H20N4O5S (320.11543500000005)
Gly Ala Ala Cys
C11H20N4O5S (320.11543500000005)
Gly Ala Cys Ala
C11H20N4O5S (320.11543500000005)
Gly Cys Ala Ala
C11H20N4O5S (320.11543500000005)
Gly Gly Gly Met
C11H20N4O5S (320.11543500000005)
Gly Gly Met Gly
C11H20N4O5S (320.11543500000005)
Gly Met Gly Gly
C11H20N4O5S (320.11543500000005)
Met Gly Gly Gly
C11H20N4O5S (320.11543500000005)
Triciribine
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite Triciribine is a DNA synthesis inhibitor, also inhibits Akt and HIV-1/2 with IC50 of 130 nM, and 0.02-0.46 μM, respectively.
3-Coumaroylquinic acid lactone
4-Coumaroylquinic acid lactone
Isomugineic acid
7-Hydroxy-6-methoxy-a-pyrufuran
2,3-Dihydro-2,3-dihydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one
Benzenamine,N,N-(1,4-phenylenedimethylidyne)bis[4-fluoro- (9CI)
C20H14F2N2 (320.11249879999997)
3-(3-amino-1-(4-chlorophenyl)butan-2-yl)benzonitrile HCl salt
1-Naphthalenecarboxylicacid, 2-(3-methoxybenzoyl)hydrazide
9,10-DIMETHOXY-2,3,4,6,7,11B-HEXAHYDRO-1H-PYRAZINO[2,1-A]ISOQUINOLINE DIHYDROCHLORIDE
C14H22Cl2N2O2 (320.10582519999997)
METHYL 3-(4-(ETHOXYCARBONYL)-3-FLUOROPHENYL)-2-FLUOROBENZOATE
Benzonitrile, 3-[(1R,2R)-2-amino-1-[(4-chlorophenyl)methyl]propyl]-, monohydrochloride, rel- (9CI)
(Z)-4-butoxy-4-oxobut-2-enoic acid,chloroethene,ethenyl acetate
C14H21ClO6 (320.10265960000004)
BIS(2-METHYLALLYL)-1,5-CYCLOOCTADIENERUTHENIUM (II)
Benzyloxycarbonyl-L-alanine N-hydroxy succinimide ester
LY2811376
C15H14F2N4S (320.09071880000005)
[4-(4-fluoro-phenyl)-piperazin-1-yl]-thiophen-3-yl-acetic acid
3-[(3-methoxyphenyl)methyl]-5-thiophen-3-yl-1H-pyrrolo[2,3-b]pyridine
3-[(3-methoxyphenyl)methyl]-5-thiophen-2-yl-1H-pyrrolo[2,3-b]pyridine
promethazine hydrochloride
C17H21ClN2S (320.11138960000005)
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent > C740 - Phenothiazine C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic D003879 - Dermatologic Agents > D000982 - Antipruritics D018926 - Anti-Allergic Agents
N-(4-acetylaminophenyl)-3-hydroxynaphthalene-2-carboxamide
Promazine hydrochloride
C17H21ClN2S (320.11138960000005)
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
[4-(4-fluoro-phenyl)-piperazin-1-yl]-thiophen-2-yl-acetic acid
5-(5-FLUORO-6-METHYLPYRIDIN-2-YL)-4-(QUINOXALIN-6-YL)-1H-IMIDAZOL-2-AMINE
Benzonitrile, 3-[(1S,2S)-2-amino-1-[(4-chlorophenyl)methyl]propyl]-, hydrochloride (1:1)
methyl 2,3,4-tri-o-acetyl-1-thio-beta-l-fucopyranoside
C13H20O7S (320.09296900000004)
5-Chloro-2-methyl-4-(trifluoromethyl)phenylboronic acid, pinacol ester
(4R,5R)-2-Chloro-1,3-dimethyl-4,5-diphenyl-1-imidazolinium Chloride
(2,5-dioxopyrrolidin-1-yl) 2-(phenylmethoxycarbonylamino)propanoate
Benzyloxycarbonyl-D-alanine N-hydroxysuccinimide ester
2-[4-Aminosulfonyl-phenyl]-ethyl-5-methylpyrazinecarboxamide
lithium,1,2-bis(ethenyl)benzene,2-ethenylbenzenesulfonate
C18H17LiO3S (320.10584020000005)
3-[3-(4-METHOXY-PHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-ACRYLIC ACID
2-thia-6-azaspiro[3.3]heptane hemioxalate
C12H20N2O4S2 (320.08644400000003)
(2R,5S,13aR)-8-methoxy-7,9-dioxo-2,3,4,5,7,9,13,13a-octahydro-2,5-methanopyrido[1,2:4,5]pyrazino[2,1-b][1,3]oxazepine-10-carboxylic acid
1-Naphthalenecarboxylicacid, 2-(4-methoxybenzoyl)hydrazide
(3-((5-Ethoxy-5-oxopentyl)oxy)-2,4,6-trifluorophenyl)boronic acid
N-(3-ethynylphenyl)-7-methoxy-6-nitroquinazolin-4-amine
1,1-[[2-(Chloromethoxy)-1,3-propanediyl]bis(oxymethylene)]bisbenzene
C18H21ClO3 (320.11791460000006)
[4-(4-chloro-phenyl)-piperazin-1-yl]-furan-2-yl-acetic acid
C16H17ClN2O3 (320.09276420000003)
4-(5-(3-(TRIFLUOROMETHYL)PHENYLAMINO)-4H-1,2,4-TRIAZOL-3-YL)PHENOL
C15H11F3N4O (320.08849119999996)
Timepidium
C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent
Tert-Butyl {2-[(1,3-Thiazol-2-Ylamino)carbonyl]pyridin-3-Yl}carbamate
(-)-Microdiplodiasolol
A member of the class of xanthones that is 4a,9a-dihydro-1H-xanthene-2,9-dione substituted by hydroxy groups at positions 1, 8 and 9a, a methoxy group at position 4 and methyl groups at positions 4a and 6 (the 1S,4aS,9aS stereoisomer). Isolated from Microdiplodia species, it exhibits antibacterial activity.
6-Oxo-6H-anthra[1,9-cd]isoxazole-3-carboxylic acid tert-butylamide
2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid
C16H17ClN2O3 (320.09276420000003)
(7R,8R)-Alpha-Diversonolic Ester
A member of the class of xanthones that is methyl 2,3,4,9-tetrahydro-1H-xanthene-1-carboxylate substituted by hydroxy groups at positions 1, 2 and 8, a methyl group at position 6 and an oxo group at position 9 (the 1R,2R stereoisomer). It has been isolated from the sea fan derived fungus Aspergillus sydowii.
2-[[6-Amino-2-(4-methoxyanilino)-5-nitro-4-pyrimidinyl]amino]ethanol
N,N-diethylcarbamodithioic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester
5-[2-Furanyl(4-morpholinyl)methyl]-2-methyl-6-thiazolo[3,2-b][1,2,4]triazolol
5-Hydroxy-8,8-dimethyl-4-phenylpyrano[2,3-h]chromen-2-one
N-[2-(4-Amino-5,8-difluoro-1,2-dihydroquinazolin-2-YL)ethyl]-3-furamide
2-(6-methyl-2-pyridyl)-N-pyrimidin-4-yl-thieno[3,2-d]pyrimidin-4-amine
C16H12N6S (320.08441120000003)
6-[5-(4-fluorophenoxy)pyridin-3-yl]-1H-benzimidazol-2-amine
gamma-L-Glutamyl-L-cysteinyl-beta-alanine
C11H18N3O6S- (320.09162680000003)
[(3S,4R)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate
[4-(6-Methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate
A butenolide that is (5-oxo-2,5-dihydrofuran-3-yl)methyl phosphate carrying an additional 6-methylheptanoyl substituent at position 4.
[(3S,4R)-4-(octanoyl)-5-oxooxolan-3-yl]methyl phosphate
2-Amino-4-oxo-4-alpha-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)-5,6, 7,8-tetrahydroxypterin
(4-octanoyl-5-oxo-2H-furan-3-yl)methyl dihydrogen phosphate
3-[[(1S)-4-amino-1-carboxy-4-oxobutyl]carbamoyl]-3-hydroxypentanedioic acid
C11H16N2O9 (320.08557659999997)
(3r,4s,5r)-3,4-Dihydroxy-5-{[(2e)-3-(4-Hydroxyphenyl)prop-2-Enoyl]oxy}cyclohex-1-Ene-1-Carboxylic Acid
(2R,3S,5R)-2-(5-Amino-7-methyl-2,6,7,9,11-pentazatricyclo[6.3.1.04,12]dodeca-1(12),3,5,8,10-pentaen-2-yl)-5-(hydroxymethyl)oxolane-3,4-diol
(E)-6,6,6-trifluoro-5-hydroxy-1,5-diphenylhex-1-en-3-one
N-[4-[(N-methylanilino)-oxomethyl]phenyl]-2-furancarboxamide
3-(4-chlorophenyl)-6-(4-methyl-1-piperazinyl)-1H-pyrimidine-2,4-dione
3,8-dimethyl-4-oxo-7,8,9,10-tetrahydro-6H-thieno[1,2]pyrimido[4,5-a]azepine-2-carboxylic acid ethyl ester
5-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-1H-pyrazole-4-carboxylic acid ethyl ester
3-Benzyl-6-(2-phenylethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
2-oxo-4-phenyl-6-(phenylmethylthio)-3,4-dihydro-1H-pyridine-5-carbonitrile
4-(2-furanyl)-N-(3-pyridinylmethyl)-6-(trifluoromethyl)-2-pyrimidinamine
C15H11F3N4O (320.08849119999996)
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-[(1-propan-2-yl-5-tetrazolyl)thio]ethanone
6-[5-[[2-(4-Morpholinyl)-2-oxoethyl]thio]-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,4-dienone
1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-4-piperidinecarboxamide
Ascomycotin A
An organic heterotricyclic compound that is 3,4-dihydro-2H,5H-pyrano[3,2-c]chromene substituted by methyl, oxo, hydroxy, methoxy and methoxycarbonyl groups at positions 2R, 4, 7, 8 and 10, respectively. It is isolated from the fungal strain Ascomycota sp. Ind19F07, which was isolated from the deep sea sediment of the Indian Ocean.
N,N-dimethyl-3-phenothiazin-10-ylpropan-1-amine;hydron;chloride
C17H21ClN2S (320.11138960000005)
(5Z)-3-(benzyliminomethyl)-5-[(4-hydroxyphenyl)methylidene]pyrrolidine-2,4-dione
N-[(Z)-(2-hydroxy-3-methoxy-5-nitrophenyl)methylideneamino]-2-(1,2,4-triazol-1-yl)acetamide
[(3S,4R)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate(2-)
A [(3S,4R)-4-alkanoyl-5-oxooxolan-3-yl]methyl phosphate(2-) obtained by deprotonation of the phosphate OH groups of [(3S,4R)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl dihydrogen phosphate; major species at pH 7.3.
tetrodotoxin(1+)
An iminium ion resulting from the protonation of the imine group of tetrodotoxin; major species at pH 7.3.
4-O-Methylepigallocatechin
A natural product found in Parapiptadenia rigida.
methyl 1,2,8-trihydroxy-6-methyl-9-oxo-3,4-dihydro-2h-xanthene-1-carboxylate
methyl (3e)-2-hydroxy-4-(8-hydroxy-7-methoxy-2-oxochromen-3-yl)-2-methylbut-3-enoate
methyl (1s,2s)-2,8-dihydroxy-6-(hydroxymethyl)-9-oxo-1,2,3,4-tetrahydroxanthene-1-carboxylate
2-(3,4-dihydroxyphenyl)-8-methoxy-3,4-dihydro-2h-1-benzopyran-3,4,7-triol
(2z)-2-[(2,5-dihydroxyphenyl)methyl]-3-[(4-methoxyphenyl)methyl]but-2-enedinitrile
methyl 4,8,9-trihydroxy-6-methyl-1-oxo-3,4-dihydro-2h-xanthene-4a-carboxylate
6-(3-hydroxy-4-methoxy-4-methyl-5-oxooxolan-2-yl)-7-methoxychromen-2-one
18-hydroxy-7-methoxy-16-methyl-10-oxatetracyclo[9.8.0.0³,⁸.0¹⁴,¹⁹]nonadeca-1(11),3(8),4,6,12,14,16,18-octaen-2-one
2-(3-methanesulfinylnona-1,3-dien-5,7-diyn-1-yl)oxan-3-yl acetate
C17H20O4S (320.10822400000006)
5,7,9,10-tetrahydroxy-2-methoxy-7-methyl-6,8-dihydro-5h-anthracene-1,4-dione
(4r,4ar,9ar)-4,8,9a-trihydroxy-3-methoxy-4a,6-dimethyl-4h-xanthene-1,9-dione
6,9-dihydroxy-3,7-dimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione
1-[7,8-dihydroxy-5-(hydroxymethyl)-6-methyl-2-oxochromen-3-yl]-2-methylbutane-1,3-dione
methyl (2s,3e)-2-hydroxy-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-3-enoate
2-[(2e)-2,3-diisocyano-4-(4-methoxyphenyl)but-2-en-1-yl]benzene-1,4-diol
4,5-dihydroxy-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohex-1-ene-1-carboxylic acid
methyl (2r)-5-hydroxy-7-methyl-4-oxo-2-[(2s)-5-oxooxolan-2-yl]-3h-1-benzopyran-2-carboxylate
3,9-dihydroxy-5-methoxy-4-phenyl-2,3-dihydrophenalen-1-one
methyl 2,3,8-trihydroxy-6-methyl-9-oxo-1,2,3,4-tetrahydroxanthene-1-carboxylate
(2s,3r)-2-[(1e,3e)-3-[(r)-methanesulfinyl]nona-1,3-dien-5,7-diyn-1-yl]oxan-3-yl acetate
C17H20O4S (320.10822400000006)
(1r,3s)-5,8,10-trihydroxy-7-methoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-6,9-dione
3-methoxy-2-(4-methoxyphenyl)-5-phenylcyclohexa-2,5-diene-1,4-dione
(1s,2s,3s)-1,2,3,5-tetrahydroxy-7-methoxy-2-methyl-3,4-dihydro-1h-anthracene-9,10-dione
8-hydroxy-2,3,8,8a-tetrahydro-2',4'-dioxaspiro[naphthalene-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),5',7',9',11'-pentaen-5-one
4-(2,3-dihydroxy-3-methylbutoxy)-9-hydroxyfuro[3,2-g]chromen-7-one
4-hydroxy-5-[(8-hydroxynaphthalen-1-yl)oxy]-3,4-dihydro-2h-naphthalen-1-one
methyl (3s,4r,4ar)-4,8,9-trihydroxy-3-methyl-1-oxo-3,4-dihydro-2h-xanthene-4a-carboxylate
methyl (2e)-4-hydroxy-4-(8-hydroxy-7-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate
3-[(1e)-2-{4'-hydroxy-5-methoxy-[1,1'-biphenyl]-2-yl}ethenyl]pyran-2-one
3,5,6,8-tetrahydroxy-7-(3-oxohexyl)naphthalene-1,2-dione
3,5,6,10-tetramethoxy-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaene-4,11-diol
4,8,10-trihydroxy-2,10,11,12-tetrahydro-1h-perylen-3-one
4-[(2r)-2,3-dihydroxy-3-methylbutoxy]-9-hydroxyfuro[3,2-g]chromen-7-one
(2r,3r,4s)-2-(3,4-dihydroxyphenyl)-8-methoxy-3,4-dihydro-2h-1-benzopyran-3,4,7-triol
1-(2e)-3-[(2r)-butan-2-yldisulfanyl]prop-2-en-1-yl 3-tert-butyl propanedioate
(2s,3s)-2,3-dihydroxy-4-(4-methoxyphenyl)-2,3-dihydrophenalen-1-one
(1r,2r,3r)-1,2,3,5-tetrahydroxy-7-methoxy-2-methyl-3,4-dihydro-1h-anthracene-9,10-dione
4,8,9a-trihydroxy-3-methoxy-4a,6-dimethyl-4h-xanthene-1,9-dione
1-(1-hydroxy-3,6-dimethoxy-5,8-dioxonaphthalen-2-yl)ethyl acetate
(2s)-1-[7,8-dihydroxy-5-(hydroxymethyl)-6-methyl-2-oxochromen-3-yl]-2-methylbutane-1,3-dione
3,6,9-trihydroxy-8-phenyl-3,4-dihydro-2h-anthracen-1-one
3,8-dihydroxy-7,9-dimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione
methyl 4-hydroxy-4-(8-hydroxy-7-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate
methyl 2,8-dihydroxy-6-(hydroxymethyl)-9-oxo-1,2,3,4-tetrahydroxanthene-1-carboxylate
(3ar,8as)-6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8h,8ah-pyrrolo[2,3-b]indole
(1r,13r)-15-methoxy-6-methyl-12,20-dioxapentacyclo[11.6.1.0²,¹¹.0³,⁸.0¹⁴,¹⁹]icosa-2(11),3,5,7,9,14(19),15,17-octaen-4-ol
(2r,3's)-3'-(hydroxymethyl)-4-methoxy-3'-[(2r,3r)-3-methyl-5-oxooxolan-2-yl]spiro[1-benzofuran-2,2'-oxiran]-3-one
(1s)-1-(1-hydroxy-3,6-dimethoxy-5,8-dioxonaphthalen-2-yl)ethyl acetate
(1r,10r,11r,15r)-4-hydroxy-15-methyl-13-oxo-9,14,16-trioxatetracyclo[8.6.0.0³,⁸.0¹¹,¹⁵]hexadeca-3,5,7-trien-6-yl acetate
methyl (2s,3e)-2-hydroxy-4-(8-hydroxy-7-methoxy-2-oxochromen-3-yl)-2-methylbut-3-enoate
(3s)-6,9-dihydroxy-3,7-dimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione
5-hydroxy-8,8-dimethyl-2-phenylpyrano[3,2-g]chromen-4-one
1,4,6,7-tetrahydroxy-2-methoxy-7-methyl-6,8-dihydro-5h-anthracene-9,10-dione
(2r,3r,4r)-2-(3-hydroxy-4-methoxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,4,7,8-tetrol
methyl 5-hydroxy-7-methyl-4-oxo-2-(5-oxooxolan-2-yl)-3h-1-benzopyran-2-carboxylate
methyl (3e)-2-hydroxy-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-3-enoate
18-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(10),4,6,8,15(20)-hexaene-14,16-dione
methyl (2e)-4-hydroxy-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate
methyl 7-hydroxy-1-methoxy-3-methyl-10-oxo-1h,3h,4h-pyrano[4,3-b]chromene-9-carboxylate
(3r)-3,6,9-trihydroxy-8-phenyl-3,4-dihydro-2h-anthracen-1-one
5,11-dimethoxy-10-(methylamino)-16-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,9,11,13,15-octaen-8-one
5-hydroxy-3-[(4-methoxyphenyl)methylidene]-6-(phenylmethylidene)-1h-pyrazin-2-one
5-hydroxy-4,12b-dimethyl-1,2-dihydrotetraphene-6,8,11-trione
(1s,2r,3s)-1,2,3,8-tetrahydroxy-6-methoxy-3-methyl-2,4-dihydro-1h-anthracene-9,10-dione
(5s,7s)-1,4,5,7-tetrahydroxy-2-methoxy-7-methyl-6,8-dihydro-5h-anthracene-9,10-dione
methyl (2e,4s)-4-hydroxy-4-(8-hydroxy-7-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate
2-{[1-hydroxy-2-(2-hydroxy-3h-indol-3-yl)ethylidene]amino}-4-methoxy-4-oxobutanoic acid
(2s,3r)-2-[(1e,3z)-3-[(r)-methanesulfinyl]nona-1,3-dien-5,7-diyn-1-yl]oxan-3-yl acetate
C17H20O4S (320.10822400000006)
1,2,3,8-tetrahydroxy-6-methoxy-3-methyl-2,4-dihydro-1h-anthracene-9,10-dione
5,7,18,20-tetraoxa-13λ⁵-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁷,²¹]tetracosa-1(24),2,4(8),9,13,15,17(21),22-octaen-13-ylium
[C19H14NO4]+ (320.09227840000005)
8-(acetyloxy)-5-formyl-3,7-dimethyl-6-oxo-8h-isochromen-7-yl acetate
4,5,6,7-tetrahydroxy-3-(3-oxohexyl)naphthalene-1,2-dione
7-(prop-1-en-2-yl)-6,11,19-trioxapentacyclo[10.8.0.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,4,7,9,13,15,17-heptaen-16-ol
5,6,7,9-tetrahydroxy-2-methoxy-7-methyl-6,8-dihydro-5h-anthracene-1,4-dione
methyl (4s,4ar)-4,8,9-trihydroxy-6-methyl-1-oxo-3,4-dihydro-2h-xanthene-4a-carboxylate
2-[(3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),3,8-triene-10,11-dione
methyl (2r,3e)-2-hydroxy-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-3-enoate
methyl (3r,4s,4as)-4,8,9-trihydroxy-3-methyl-1-oxo-3,4-dihydro-2h-xanthene-4a-carboxylate
(7r,8s)-8-(acetyloxy)-5-formyl-3,7-dimethyl-6-oxo-8h-isochromen-7-yl acetate
3,5-dihydroxy-4-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohex-1-ene-1-carboxylic acid
(8r,8as)-8-hydroxy-2,3,8,8a-tetrahydro-2',4'-dioxaspiro[naphthalene-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),5',7',9',11'-pentaen-5-one
(3z,6z)-3-[(4-methoxyphenyl)methylidene]-6-(phenylmethylidene)pyrazine-2,5-diol
methyl (1r,2s)-2,8-dihydroxy-6-(hydroxymethyl)-9-oxo-1,2,3,4-tetrahydroxanthene-1-carboxylate
methyl (2e,4s)-4-hydroxy-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate
methyl 5-hydroxy-2-(3-methyl-5-oxooxolan-2-yl)-4-oxo-3h-1-benzopyran-2-carboxylate
{2-[6-bromo-1-(3-methylbut-2-en-1-yl)indol-3-yl]ethyl}(methyl)amine
(10r)-4,8,10-trihydroxy-2,10,11,12-tetrahydro-1h-perylen-3-one
(3r,4s,5r)-3,5-dihydroxy-4-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohex-1-ene-1-carboxylic acid
2-(3,4-dihydroxy-5-methoxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
2-(3-hydroxy-4-methoxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,4,7,8-tetrol
5-hydroxy-8,8-dimethyl-2-phenylpyrano[2,3-f]chromen-4-one
(3as,8ar)-6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8h,8ah-pyrrolo[2,3-b]indole
methyl (1r,3s)-7-hydroxy-1-methoxy-3-methyl-10-oxo-1h,3h,4h-pyrano[4,3-b]chromene-9-carboxylate
(3r,4s,5r)-4,5-dihydroxy-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohex-1-ene-1-carboxylic acid
(1r,2r,3s)-1,2,3,5-tetrahydroxy-7-methoxy-2-methyl-3,4-dihydro-1h-anthracene-9,10-dione
5-hydroxy-7-methoxy-8-(4-methoxy-5-oxooxolan-2-yl)-2-methylchromen-4-one
(2s,3's)-3'-(hydroxymethyl)-4-methoxy-3'-[(2r,3r)-3-methyl-5-oxooxolan-2-yl]spiro[1-benzofuran-2,2'-oxiran]-3-one
methyl (11s,12s)-7,12-dihydroxy-13-methyl-9-oxo-2,15-dioxatricyclo[8.5.0.0³,⁸]pentadeca-3,5,7,13-tetraene-11-carboxylate
(4r,4as,9as)-4,8,9a-trihydroxy-3-methoxy-4a,6-dimethyl-4h-xanthene-1,9-dione
methyl (2e,4r)-4-hydroxy-4-(8-hydroxy-7-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate
(4s)-3,4-dihydro-2h-2',4'-dioxaspiro[naphthalene-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),5',7',9',11'-pentaene-4,5-diol
6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8h,8ah-pyrrolo[2,3-b]indole
methyl 2-hydroxy-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-3-enoate
3,6-dihydroxy-7,9-dimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione
5,7,17,19-tetraoxa-13λ⁵-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁶,²⁰]tetracosa-1(24),2,4(8),9,13,15,20,22-octaen-13-ylium
[C19H14NO4]+ (320.09227840000005)
methyl (1r,2r)-1,2,8-trihydroxy-6-methyl-9-oxo-3,4-dihydro-2h-xanthene-1-carboxylate
5,8,10-trihydroxy-7-methoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-6,9-dione
(3s)-3,6-dihydroxy-7,9-dimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione
2-(3,5-dihydroxy-4-methoxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
(2r)-2-({1-hydroxy-2-[(3s)-2-hydroxy-3h-indol-3-yl]ethylidene}amino)-4-methoxy-4-oxobutanoic acid
(1s,2r,4r)-1,2,4,5-tetrahydroxy-7-methoxy-2-methyl-3,4-dihydro-1h-anthracene-9,10-dione
2-[(1e)-3-methanesulfinylnona-1,3-dien-5,7-diyn-1-yl]oxan-3-yl acetate
C17H20O4S (320.10822400000006)