Exact Mass: 294.0422
Exact Mass Matches: 294.0422
Found 437 metabolites which its exact mass value is equals to given mass value 294.0422,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Estazolam
Estazolam is only found in individuals that have used or taken this drug. It is a benzodiazepine with anticonvulsant, hypnotic, and muscle relaxant properties. It has been shown in some cases to be more potent than diazepam or nitrazepam. [PubChem]Benzodiazepines bind nonspecifically to benzodiazepine receptors, which affects affects muscle relaxation, anticonvulsant activity, motor coordination, and memory. As benzodiazepine receptors are thought to be coupled to gamma-aminobutyric acid-A (GABAA) receptors, this enhances the effects GABA by increasing GABA affinity for the GABA receptor. Binding of the inhibitory neurotransmitter GABA to the site opens the chloride channel, resulting in a hyperpolarized cell membrane that prevents further excitation of the cell. N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CD - Benzodiazepine derivatives D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants
(3S,4R)-3,4,5-trihydroxy-8-oxospiro[6,7-dihydronaphthalene-5,2-oxolane]-2-carboxylic acid
Filiformin
Laurinterol
A sesquiterpenoid isolated from Laurencia intermedia and Aplysia kurodai and has been found to exhibit antibacterial activity,
Methoxybrassenin B
Methoxybrassenin B is found in brassicas. Methoxybrassenin B is a stress metabolite isolated from cabbage inoculated with Pseudomonas cichorii. Stress metabolite isolated from cabbage inoculated with Pseudomonas cichorii. Methoxybrassenin B is found in brassicas.
Wasalexin A
Wasalexin A is found in brassicas. Wasalexin A is a constituent of Wasabia japonica (Japanese horseradish) Constituent of Wasabia japonica (Japanese horseradish). Wasalexin A is found in brassicas and wasabi.
7-Acetoxy-2-methylisoflavone
7-Acetoxy-2-methylisoflavone is found in herbs and spices. 7-Acetoxy-2-methylisoflavone is isolated from Glycyrrhiza glabra (licorice
gamma-L-Glutamyl-L-methionine sulfoxide
gamma-L-Glutamyl-DL-methionine sulfoxide is found in nuts. gamma-L-Glutamyl-DL-methionine sulfoxide is isolated from the seeds of Fagus silvatica (beechnuts). Isolated from the seeds of mung bean (Vigna radiata) and black gram (Vigna mungo). gamma-L-Glutamyl-L-methionine sulfoxide is found in pulses.
Sulfacytine
Sulfacytine is a short-acting sulfonamide. The sulfonamides are synthetic bacteriostatic antibiotics with a wide spectrum against most gram-positive and many gram-negative organisms. However, many strains of an individual species may be resistant. Sulfonamides inhibit multiplication of bacteria by acting as competitive inhibitors of p-aminobenzoic acid in the folic acid metabolism cycle. Bacterial sensitivity is the same for the various sulfonamides, and resistance to one sulfonamide indicates resistance to all. Most sulfonamides are readily absorbed orally. However, parenteral administration is difficult, since the soluble sulfonamide salts are highly alkaline and irritating to the tissues. The sulfonamides are widely distributed throughout all tissues. High levels are achieved in pleural, peritoneal, synovial, and ocular fluids. Although these drugs are no longer used to treat meningitis, CSF levels are high in meningeal infections. Sulfacytine is a competitive inhibitor of the enzyme dihydropteroate synthetase. It inhibits bacterial synthesis of of dihydrofolic acid by preventing the condensation of the pteridine with para-aminobenzoic acid (PABA), a substrate of the enzyme dihydropteroate synthetase. The inhibited reaction is necessary in these organisms for the synthesis of folic acid. C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
3-Methoxy-2-(4-methylbenzoyl)-4H-1-benzopyran-4-one
3-Methoxy-2-(4-methylbenzoyl)-4H-1-benzopyran-4-one is found in fruits. 3-Methoxy-2-(4-methylbenzoyl)-4H-1-benzopyran-4-one is a constituent of the roots of Mangifera indica (mango)
Wasalexin B
Wasalexin B is found in brassicas. Wasalexin B is a constituent of Wasabia japonica (Japanese horseradish) Constituent of Wasabia japonica (Japanese horseradish). Wasalexin B is found in brassicas and wasabi.
4-[(2,4-Dihydroxyphenyl)azo]benzenesulfonic acid
4-[(2,4-Dihydroxyphenyl)azo]benzenesulfonic acid is a food dye; no longer permitted in the EU. Food dye; no longer permitted in the EU
6-Hydroxymethylsulfadimidine
D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
Benzenesulfonamide, 4-amino-N-(5-hydroxy-4,6-dimethyl-2-pyrimidinyl)-
D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
Lanceolatin C
Pongamol (Lanceolatin C) is potent α-glucosidase inhibitor (IC50=103.5 μM) and has free-radical (DPPH) scavenging,antihyperglycemic, and antihyperglycemic activities[1].
3,4-Bis(carboxymethyl)-3,4-dihydroxyhexanedioic acid
Sulfametomidine
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01E - Sulfonamides and trimethoprim > J01ED - Long-acting sulfonamides C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
N~4~-Cyclopropyl-6-(2,3-Dichlorophenyl)pyrimidine-2,4-Diamine
Isoaplysin
Neolaurinterol
2-[3-(bromomethylene)-1,2-dimethylcyclopentyl]-5-methylphenol
Cyclolaurenol
(+)-2-(Bromomethyl)-2,3,4,5-tetrahydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin
Mesulfenfos
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3707 CONFIDENCE standard compound; INTERNAL_ID 3014
2-Anilino-6-oxo-4-(2-thienyl)-1,6-dihydropyrimidine-5-carbonitrile
OCP_295.0845_17.0
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1303
hydroxymethylenetanshinquinone
9,10-Anthracenedione, 2-acetyl-1-hydroxy-3,6-dimethyl-
4-Hydroxy-6-(4-hydroxyphenyl)-5H-furo[3,2-g][1]benzopyran-5-one
(2S,3S)-3-O-caffeyl-2,3,4-trihydroxy-2-methylbutan-1,4-olide|3-O-Caffeoyl-2-C-methyl-D-erythrono-1,4-lactone
1,2-Dihydro-1,6-dimethyl-3,11-dioxanaphth[2,1-e]azulene-10,12-dione
9-hydroxy-2-isopropenyl-1,8-dioxa-dicyclopenta[b,g]naphthalene-4,10-dione
1-Hydroxy-2-acetyl-3,7-dimethyl-9,10-anthraquinone
2-(4,5,5-Trimethyl-1-cyclopentenyl)-4-bromo-5-methylphenol
1,3-Propanedione, 1-(4-methoxy-5-benzofuranyl)-3-phenyl-
9-((Z)-bromomethylidene)-1,2,5-trimethylspiro<5.5>undeca-1,7-dien-3-one|9-((Z)-bromomethylidene)-1,2,5-trimethylspiro[5.5]undeca-1,7-dien-3-one
3,4-(Methylenedioxy)-8-methoxy-10-hydroxyphenanthrene-1-carboxylic acid lactone
3,4-Dihydroxy-5-(2,3,4-trihydroxyphenoxy)benzoic acid
(3Z,6Z,9Z)-13-bromo-5,12-epoxypentadeca-3,6,9-trien-1-yne
{(Z)-3-(chloromethylene)-2,3-dihydrobenzo[b]oxepin-7-yl}methyl trimethysilyl ether
(3Z,6Z,9Z)-12-bromo-5,13-epoxypentadeca-3,6,9-trien-1-yne
3-methyl-8,9-methylenedioxycoumestone|flemmichapparin C
3-(6,8-dimethoxy-1-oxoisochromen-3-yl)-2-hydroxypropanoic acid
2-(2-hydroxyphenyl)-4-phenylbenzene-1,3,5-triol
estazolam
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CD - Benzodiazepine derivatives D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants
Sulfacytine
C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
Wasalexin A
Wasalexin B
g-L-Glutamyl-L-methionine sulfoxide
1,1,1-Trifluoro-N-(1,2,3,4-tetrahydro-1-methyl-7-quinolinyl)-methanesulfonamide
Sodium citrate dihydrate
D000074385 - Food Ingredients > D005503 - Food Additives > D005520 - Food Preservatives D006401 - Hematologic Agents > D000925 - Anticoagulants D019995 - Laboratory Chemicals > D002021 - Buffers Sodium citrate dehydrate is an anticoagulant and also used as a buffer and food preservatives. Sodium citrate dehydrate is an anticoagulant and also used as a buffer and food preservatives.
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-propoxyethanimidamide
3-[(2-CHLORO-6-FLUOROBENZYL)OXY]-4-METHOXYBENZALDEHYDE
3-[(2-CHLORO-4-FLUOROBENZYL)OXY]-4-METHOXYBENZALDEHYDE
1-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)-3,5-DIMETHYL-1H-PYRAZOLEHYDROBROMIDE
n,n-bis(2-hydroxyethyl)-4-phenylenediamine sulphate
3-amino-4-chloro-N-(5-chloro-2-methylphenyl)benzamide
methyl 2-[(2-chloroacetyl)amino]-3-(1h-indol-3-yl)propanoate
2-tert-Butoxycarbonylamino-benzothiazole-4-carboxylic acid
10-CHLORO-2,3,4,6,7,11B-HEXAHYDRO-1H-PYRAZINO[2,1-A]ISOQUINOLINE DIHYDROCHLORIDE
3-AMINO-3-[5-(3-CHLORO-4-METHOXYPHENYL)-FURAN-2-YL]-PROPIONIC ACID AMIDE
2-[(2-CHLORO-6-FLUOROBENZYL)OXY]-3-METHOXYBENZALDEHYDE
2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxybenzaldehyde
N,N-Bis(2-hydroxyethyl)-p-phenylenediamine sulphate
4-FORMYL-5-(TRIFLUOROMETHYL)-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
1-[(4-NITROBENZYLOXY)CARBONYL]-PYRROLIDINE-2-CARBOXYLIC ACID
1,1,1-Trifluoro-2-trifluoromethyl-2-hydroxy-4-pentyl methacrylate
2-(N-CARBOXYMETHYL-N-PHENYL)AMINO-4,6-DIMERCAPTO-1,3,5-TRIAZINE
CYCLOHEPTA[B]PYRAN-4,9-DIONE, 2-(1,3-BENZODIOXOL-5-YL)-
Cliprofen
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
4-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxybenzaldehyde
2-(4-isothiocyanatophenyl)-N,N-dimethyl-1-benzofuran-6-amine,hydrochloride
Ethyl 2-(pyrrolidin-1-yl)-4-trifluoromethyl-1,3-thiazole-5-carboxylate
6-chloro-N-(oxan-4-ylmethyl)-5-(trifluoromethyl)pyridin-2-amine
6-METHOXY-3-[4-(TRIFLUOROMETHYL)PHENYL][1,2,4]TRIAZOLO[4,3-B]PYRIDAZINE
2-[hydroxy(2-prop-2-enoyloxyethoxy)phosphoryl]oxyethyl prop-2-enoate
4-(AMINOMETHYL)-2-(4-TRIFLUOROMETHYL)PHENYL-1,3-THIAZOLE HYDROCHLORIDE 95{2-[4-(TRIFLUOROMETHYL)PHENYL]-1,3-THIAZOL-4-YL}METHYLAMINE HYDROCHLORIDE
(Z)-4-(4-Nitrobenzylidene)-2-phenyloxazol-5(4H)-one
(Z)-4-(2-Nitrobenzylidene)-2-phenyloxazol-5(4H)-one
5-OXO-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL TRIFLUOROMETHANESULFONATE
4-[6-Chloro-2-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinecarbal dehyde
Sulfaethoxypyridazine
D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
3-amino-4-chloro-N-(4-chloro-3-methylphenyl)benzamide
4-Chloro-7-(3-chloropropoxy)-6-methyl-3-quinolinecarbonitrile
6-CHLORO-9A-(2-FLUOROETHYL)-7-METHOXY-9,9A-DIHYDRO-1H-FLUOREN-3(2H)-ONE
6-chloro-N-[(4-methoxyphenyl)methyl]-5-nitropyrimidin-4-amine
Lofexidine hydrochloride
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 D002491 - Central Nervous System Agents > D009292 - Narcotic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents Lofexidine (hydrochloride) is a selective α2-receptor agonist, commonly used to alleviate the physical symptoms of heroin and other types of opioid withdrawal[1][2].
4-(6-METHOXY-BENZOTHIAZOL-2-YLCARBAMOYL)-BUTYRIC ACID
6-N-Benzyl-2-chloro-5,6,7,8-tetrahydro-1,6-naphthyridine HCl
4,4,4-trifluoro-3-hydroxy-3-(4-phenylphenyl)butan-2-one
2-(2,2,3,3,4,4,4-heptafluorobutanoyl)cyclohexan-1-one
8-chloro-9a-(2-fluoroethyl)-7-methoxy-2,9-dihydro-1H-fluoren-3-on e
(1S,4S)-(+)-2-(3-CHLORO-BENZYL)-2,5-DIAZA-BICYCLO[2.2.1]HEPTANE DIHYDROCHLORIDE
4-[(2-CHLORO-4-FLUOROBENZYL)OXY]-3-METHOXYBENZALDEHYDE
Nuclomedone
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
Aluminum Lactate
C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent
(5-BROMO-2-HYDROXYPHENYL)(1-ETHYL-1H-PYRAZOL-4-YL)METHANONE
(6E)-6-[(2-chloro-6-fluorophenyl)methylidene]-7H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
6-[(2-chloro-6-fluorophenyl)methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
4-(4-Chloro-phenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester
2-(4-methoxyphenyl)imino-3-methyl-4-oxo-1,3-thiazinane-6-carboxylic acid
(2S,3R,4S,5S)-5-(chloromethyl)tetrahydrofuran-2,3,4-triyl triacetate
(NZ)-N-[3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-(trideuteriomethyl)-1,3,5-oxadiazinan-4-ylidene]nitramide
2-[2-(3,4-dimethoxyanilino)-1,3-thiazol-4-yl]acetic acid
3-cyano-4-trifluoromethyl-6-(4-methoxyphenyl)-pyridine-2-one
methyl 2-[1-(4-methylphenyl)sulfonylimidazol-4-yl]acetate
4,4,5,5-TETRAMETHYL-2-(PERFLUOROPHENYL)-1,3,2-DIOXABOROLANE
5-(4-chlorophenyl)-2-(1,3-dioxolan-2-yl)-3-furoic acid
5-AMINO-1-CYCLOPROPYL-6,7-DIFLUORO-1,4-DIHYDRO-8-METHYL-4-OXO-3-QUINOLINECARBOCYLIC ACID
9-chloro-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline,dihydrochloride
2,4-dichloro-N-(4-methoxyphenyl)benzenecarboximidamide
N~4~-Cyclopropyl-6-(2,3-Dichlorophenyl)pyrimidine-2,4-Diamine
Solaraze
D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors
N4-(3-chlorophenyl)-N2-methyl-5-nitropyrimidine-2,4,6-triamine
N5-(2,4-dichlorophenyl)pyrazolo[3,4-d]pyrimidine-4,5-diamine
3-ethyl-2-sulfanyl-5-(thiophen-2-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one
5-Methyl-alpha-((5-nitro-2-furanyl)methylene)-1H-benzimidazole-2-acetonitrile
5-[(3-methyl-2-thienyl)methylene]-2-(4-morpholinyl)-1,3-thiazol-4(5H)-one
4-Methyl-alpha-((5-nitro-2-furanyl)methylene)-1H-benzimidazole-2-acetonitrile
(2E)-4-(4-(2-Chlorophenyl)-1-piperazinyl)-4-oxo-2-butenoic acid
4-Chloro-6-(4-piperazin-1-YL-1H-pyrazol-5-YL)benzene-1,3-diol
1-((2-Hydroxyethoxy)methyl)-5-(phenylthio)pyrimidine-2,4(1H,3H)-dione
(3r)-4,4-Difluoro-3-[(4-Methoxyphenyl)sulfonyl]butanoic Acid
5-amino-1-(5-phosphonato-beta-D-ribosyl)imidazol-3-ium
An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups as well as protonation of the endocyclic nitrogen at position 3 in the imidazole ring of 5-amino-1-(5-phospho-beta-D-ribosyl)imidazole. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
5-methyl-N-(4-nitrophenyl)-1,1-dioxo-1lambda6-thiophene-2-carboxamide
4-Amino-5-(2-amino-4-methylsulfanylbutanoyl)peroxy-5-oxopentanoic acid
3-Chloro-4-(dimethylamino)-6-(4-nitrophenyl)-2-pyranone
5-amino-1-(5-phosphonato-D-ribosyl)imidazol-3-ium
Conjugate base of 5-amino-1-(5-phospho-D-ribosyl)imidazole. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3-(4-chlorophenyl)-5-(4,5-dihydro-1H-imidazol-2-ylsulfanylmethyl)-1,2,4-oxadiazole
3-phenyl-2-sulfanylidene-1H-benzofuro[3,2-d]pyrimidin-4-one
1-(3-Chloro-4-methoxyphenyl)-3-(2-fluorophenyl)urea
N-(3-acetylphenyl)-3,5-dimethyl-4-isoxazolesulfonamide
(5Z)-2-(benzylamino)-5-benzylidene-1,3-thiazol-4-one
3-[(2,5,6-Trimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-2-oxolanone
3-Chloro-1-(2,4-dimethylphenyl)-4-(2-hydroxyethylamino)pyrrole-2,5-dione
2-[1-(2-Methylphenyl)-3-oxo-3-thiophen-2-ylpropyl]propanedinitrile
2-[5-(Anilinomethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]acetic acid
2-Bromo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazolin-12-ol
N4-(4-Chlorophenyl)-N2-methyl-5-nitropyrimidine-2,4,6-triamine
5-[2-(4-bromophenyl)-2-oxoethyl]-2,3-dihydro-1H-pyrazin-6-one
Carbonyl(eta(5)-cyclopentadienyl)(1,3-dimethylimidazolidin-2-ylidene)rhodium
6-(1-Carboxy-2-methoxy-2-oxoethyl)-3,4,5-trihydroxyoxane-2-carboxylic acid
(Z)-3-(3-Chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-N-propan-2-ylprop-2-enamide
3,4,5-Trihydroxy-6-(3-methoxy-3-oxopropanoyl)oxyoxane-2-carboxylic acid
3-(6,8-Dimethoxy-1-oxoisochromen-3-yl)-2-hydroxypropanoic acid
Sulfametomidine
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01E - Sulfonamides and trimethoprim > J01ED - Long-acting sulfonamides C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
3-Methoxy-2-(4-methylbenzoyl)-4H-1-benzopyran-4-one
Sodium citrate
Sodium citrate dehydrate is an anticoagulant and also used as a buffer and food preservatives. Sodium citrate dehydrate is an anticoagulant and also used as a buffer and food preservatives.
SIRT1-IN-3
SIRT1-IN-3 (compound 3j) is a potent and selective SIRT1 inhibitor, with an IC50 of 4.2 μM[1].
4-hydroxy-4-methyl-5-oxooxolan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate
16-hydroxy-5-(prop-1-en-2-yl)-4,14-dioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1(9),3(7),5,10,12,15-hexaene-2,8-dione
4-bromo-2-[(1s,3r)-1,3-dimethyl-2-methylidenecyclopentyl]-5-methylphenol
2-(1-bromopropyl)-9-(but-1-en-3-yn-1-yl)-2,3,6,9-tetrahydrooxonine
3-[5-carboxy-4-(carboxymethyl)pyrrolidin-3-yl]pyridine-2-carboxylic acid
2-[(1e)-2-methanesulfinylethenyl]-7,8-dimethoxychromen-4-one
4-bromo-2-[(1r,3s)-1,3-dimethyl-2-methylidenecyclopentyl]-5-methylphenol
(12s)-7-methoxy-12-phenyl-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1,3,6,8-tetraen-10-one
4-bromo-1,5,9,12-tetramethyl-8-oxatricyclo[7.2.1.0²,⁷]dodeca-2(7),3,5-triene
(6r,9e)-9-(bromomethylidene)-1,5,5-trimethylspiro[5.5]undeca-1,7-dien-3-one
(4r)-4-benzyl-4-methoxy-3,10-dioxatricyclo[7.3.0.0²,⁶]dodeca-1,6,8,11-tetraen-5-one
{[3-(chloromethylidene)-2h-1-benzoxepin-7-yl]methoxy}trimethylsilane
(?)-(2s)-6-methoxy-[2'',3'':7,8]-furanoflavanone
{"Ingredient_id": "HBIN006775","Ingredient_name": "(?)-(2s)-6-methoxy-[2'',3'':7,8]-furanoflavanone","Alias": "NA","Ingredient_formula": "C18H14O4","Ingredient_Smile": "COC1=C2C(=C3C(=C1)C(=O)CC(O3)C4=CC=CC=C4)C=CO2","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13927","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-β-hydroxymethylenetanshiquinone
{"Ingredient_id": "HBIN008250","Ingredient_name": "3-\u03b2-hydroxymethylenetanshiquinone","Alias": "NA","Ingredient_formula": "C18H14O4","Ingredient_Smile": "CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCC(C4=C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15888","TCMID_id": "10491","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-beta-Hydroxymethyllenetanshiquinone
{"Ingredient_id": "HBIN008251","Ingredient_name": "3-beta-Hydroxymethyllenetanshiquinone","Alias": "(7S)-7-hydroxy-1-methyl-6-methylene-8,9-dihydro-7H-naphtho[8,7-g]benzofuran-10,11-quinone; (7S)-7-hydroxy-1-methyl-6-methylidene-8,9-dihydro-7H-naphtho[8,7-g][1]benzoxole-10,11-dione; (7S)-7-hydroxy-1-methyl-6-methylene-8,9-dihydro-7H-naphtho[8,7-g]benzofuran-10,11-dione; 3-beta-hydroxymethyllenetanshiquinone","Ingredient_formula": "C18H14O4","Ingredient_Smile": "Not Available","Ingredient_weight": "294.32","OB_score": "32.16103376","CAS_id": "NA","SymMap_id": "SMIT00958","TCMID_id": "31235","TCMSP_id": "MOL007059","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
aristololide
{"Ingredient_id": "HBIN016823","Ingredient_name": "aristololide","Alias": "NA","Ingredient_formula": "C17H10O5","Ingredient_Smile": "NA","Ingredient_weight": "294.26","OB_score": "NA","CAS_id": "86030-64-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6656","PubChem_id": "NA","DrugBank_id": "NA"}
