Exact Mass: 304.04402500000003
Exact Mass Matches: 304.04402500000003
Found 500 metabolites which its exact mass value is equals to given mass value 304.04402500000003,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(+)-taxifolin
Taxifolin, also known as dihydroquercetin or (+)-taxifolin, is a member of the class of compounds known as flavanonols. Flavanonols are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a hydroxyl group and a ketone at the carbon C2 and C3, respectively. Taxifolin is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Taxifolin can be found in a number of food items such as sweet rowanberry, arrowroot, evening primrose, and walnut, which makes taxifolin a potential biomarker for the consumption of these food products. Taxifolin is a flavanonol, a type of flavonoid . D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2]. Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2].
Melphalan
An alkylating nitrogen mustard that is used as an antineoplastic in the form of the levo isomer - melphalan, the racemic mixture - merphalan, and the dextro isomer - medphalan; toxic to bone marrow, but little vesicant action; potential carcinogen. [PubChem] L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AA - Nitrogen mustard analogues D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D000970 - Antineoplastic Agents > D019653 - Myeloablative Agonists D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
N-acetyl-aspartyl-glutamate (NAAG)
N-Acetylaspartylglutamate (NAAG) is a neuropeptide found in millimolar concentrations in the brain that is localized to subpopulations of glutamatergic, cholinergic, GABAergic, and noradrenergic neuronal systems. NAAG is released upon depolarization by a Ca(2+)-dependent process and is an agonist at mGluR3 receptors and an antagonist at NMDA receptors. NAAG is catabolized to N-acetylaspartate and glutamate primarily by glutamate carboxypeptidase II, which is expressed on the extracellular surface of astrocytes. The levels of NAAG and the activity of carboxypeptidase II are altered in a regionally specific fashion in several neuropsychiatric disorders (PMID:9361299). N-Acetylaspartylglutamic acid (NAAG) is a purported precursor of N-acetylaspartic acid (NAA) and is present at about one-tenth of the concentration of NAA in the brain. NAAG has been reported to activate N-methyl-D-aspartic acid (NMDA) receptors in neurons. Previous immunohistochemical studies in the vertebrate central nervous system (CNS) have suggested that NAAG is exclusively localized to neurons. Recent evidence, however, indicates that NAAG might also be localized to nonneuronal cells within the CNS. Only traces of NAA and NAAG are detectable in other tissues. Some compounds can change levels of NAA and NAAG in the brain. For example, methylphenidate increases the levels of NAA and NAAG in the cerebral cortex; amphetamine also increases NAA concentration in a mature brain by 26\\\%, raising the possibility that other neurochemical systems might be involved in the clinical effects of stimulants (PMID:10603234). N-Acetylaspartylglutamate (NAAG) is a neuropeptide found in millimolar concentrations in brain that is localized to subpopulations of glutamatergic, cholinergic, GABAergic, and noradrenergic neuronal systems. NAAG is released upon depolarization by a Ca(2+)-dependent process and is an agonist at mGluR3 receptors and an antagonist at NMDA receptors. NAAG is catabolized to N-acetylaspartate and glutamate primarily by glutamate carboxypeptidase II, which is expressed on the extracellular surface of astrocytes. The levels of NAAG and the activity of carboxypeptidase II are altered in a regionally specific fashion in several neuropsychiatric disorders. (PMID 9361299) D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D009676 - Noxae > D009498 - Neurotoxins D018926 - Anti-Allergic Agents D020011 - Protective Agents Spaglumic Acid (N-Acetylaspartylglutamic acid) is a neuropeptide found in millimolar concentrations in brain.
Tetrangulol
A member of the class of tetraphenes that is tetraphene-7,12-dione substituted by hydroxy groups at positions 1 and 8 and a methyl group at position 3.
Medphalan
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D000970 - Antineoplastic Agents > D019653 - Myeloablative Agonists D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents
spaglumic acid
R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AC - Antiallergic agents, excl. corticosteroids C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent > C29714 - Mast Cell Stabilizer D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists S - Sensory organs > S01 - Ophthalmologicals > S01G - Decongestants and antiallergics D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D009676 - Noxae > D009498 - Neurotoxins D018926 - Anti-Allergic Agents D020011 - Protective Agents Spaglumic Acid (N-Acetylaspartylglutamic acid) is a neuropeptide found in millimolar concentrations in brain.
Medphalan
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds D000970 - Antineoplastic Agents > D019653 - Myeloablative Agonists D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents
Taxifolin
(+)-taxifolin is a taxifolin that has (2R,3R)-configuration. It has a role as a metabolite. It is a conjugate acid of a (+)-taxifolin(1-). It is an enantiomer of a (-)-taxifolin. Taxifolin is a natural product found in Austrocedrus chilensis, Smilax corbularia, and other organisms with data available. See also: Milk Thistle (part of); Maritime Pine (part of). D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics A taxifolin that has (2R,3R)-configuration. D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2]. Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2].
Thymidine 3',5'-cyclic monophosphate
Thymidine 3,5-cyclic monophosphate is an intermediate in the Pyrimidine metabolism. Is the product or substrate of the enzymes Thymidylate synthase (EC 2.1.1.45), Thymidylate synthase (FAD) (EC 2.1.1.148), Thymidine kinase (EC 2.7.1.21), AMP-thymidine kinase (EC 2.7.1.114), ADP-thymidine kinase (EC 2.7.1.118), dTMP kinase (EC 2.7.4.9), T2-induced deoxynucleotide kinase (EC 2.7.4.12), 5-nucleotidase (EC 3.1.3.5), Thymidylate 5-phosphatase (EC 3.1.3.35), and ATP-diphosphatase (EC 3.6.1.5). (KEGG) [HMDB] Thymidine 3,5-cyclic monophosphate is an intermediate in the pyrimidine metabolism. It is the product or substrate of the enzymes thymidylate synthase (EC 2.1.1.45), thymidylate synthase (FAD) (EC 2.1.1.148), thymidine kinase (EC 2.7.1.21), AMP-thymidine kinase (EC 2.7.1.114), ADP-thymidine kinase (EC 2.7.1.118), dTMP kinase (EC 2.7.4.9), T2-induced deoxynucleotide kinase (EC 2.7.4.12), 5-nucleotidase (EC 3.1.3.5), Thymidylate 5-phosphatase (EC 3.1.3.35), and ATP-diphosphatase (EC 3.6.1.5).
Taxifolin
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2]. Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2].
3-(3,4-dihydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propane-1,2-dione
Pratenol B
Pratenol B is found in herbs and spices. Pratenol B is a constituent of Trifolium pratense (red clover). Constituent of Trifolium pratense (red clover). Pratenol B is found in tea and herbs and spices.
Musanolone E
Musanolone E is found in fruits. Musanolone E is a constituent of Musa acuminata (dwarf banana). Constituent of Musa acuminata (dwarf banana). Musanolone E is found in fruits.
4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one
4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one is found in fruits. 4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one is isolated from Musa acuminata (dwarf banana). Isolated from Musa acuminata (dwarf banana). 4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one is found in fruits.
2-(4-Methoxyphenyl)naphthalic anhydride
2-(4-Methoxyphenyl)naphthalic anhydride is found in fruits. 2-(4-Methoxyphenyl)naphthalic anhydride is isolated from the unripe banana fruit (Musa acuminata) infected with Colletotrichum musae. Isolated from the unripe banana fruit (Musa acuminata) infected with Colletotrichum musae. 2-(4-Methoxyphenyl)naphthalic anhydride is found in fruits.
(±)-Conen
(±)-Conen is a fungicide, used against rice blas
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-3'-O-sulphate
C11H12O8S (304.02528720000004)
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-sulphate belongs to the family of Catechols. These are compounds containing a 1,2-benzenediol moiety.
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-4'-O-sulphate
C11H12O8S (304.02528720000004)
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-sulphate belongs to the family of Resorcinols. These are compounds containing a resorcinol moiety, which is a benzene ring bearing two hydrocyl groups at positions 1 and 3.
Sinapic acid 4-O-sulfate
C11H12O8S (304.02528720000004)
Sinapic acid 4-O-sulfate is an endogenous phenolic acid metabolite. Sinapic acid 4-O-sulfate was found to be elevated in rat urine after whole rye consumption which makes this compound a potential urinary biomarker of whole grain intake (PMID: 26862900).
Demonomethylchlorpromazine
Demonomethylchlorpromazine is a metabolite of chlorpromazine. Chlorpromazine (as chlorpromazine hydrochloride, abbreviated CPZ; marketed in the United States as Thorazine and elsewhere as Largactil) is a typical antipsychotic. First synthesized on December 11, 1950, chlorpromazine was the first drug developed with specific antipsychotic action, and would serve as the prototype for the phenothiazine class of drugs, which later grew to comprise several other agents. (Wikipedia)
(2R)-2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one
Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2]. Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2].
2-(3,4-Dihydroxy-phenyl)-3,5,7-trihydroxy-chroman-4-one
Clobuzarit
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
Flobufen
C17H14F2O3 (304.09109579999995)
Pterocarpanquinone
N(1)-Ethylchlorpropamide
C12H17ClN2O3S (304.06483620000006)
N-Acetyl-1-aspartylglutamic acid
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D009676 - Noxae > D009498 - Neurotoxins D018926 - Anti-Allergic Agents D020011 - Protective Agents Spaglumic Acid (N-Acetylaspartylglutamic acid) is a neuropeptide found in millimolar concentrations in brain.
4-(6-Carbamoyl-5-formyl-2H-pyran-4-yl)-5-formyl-2H-pyran-6-carboxamide
Arctinone A acetate
Arctinone a acetate is a member of the class of compounds known as bi- and oligothiophenes. Bi- and oligothiophenes are organic compounds containing two or more linked thiophene rings. Thiophene is a five-member aromatic ring with one sulfur and four carbon atoms. Arctinone a acetate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctinone a acetate can be found in burdock, which makes arctinone a acetate a potential biomarker for the consumption of this food product.
Dihydrorobinetin
Dihydrorobinetin is a natural product found in Robinia pseudoacacia and Adenanthera pavonina Dihydrorobinetin is a naturally occurring organic compound, classified as a flavanonol, which is a type of flavonoid. It is the dihydro derivative of robinetin, meaning it has two additional hydrogen atoms compared to robinetin. The chemical formula of dihydrorobinetin is C15H14O6. This compound is found in various plants and has been studied for its potential biological activities, including antioxidant and anti-inflammatory properties. Dihydrorobinetin, like other flavonoids, is known for its ability to scavenge free radicals and modulate cellular processes, which may contribute to its health benefits. (+)-Dihydrorobinetin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=4382-33-6 (retrieved 2024-07-12) (CAS RN: 4382-33-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Alphitonin
A hydroxyaurone that is aurone substituted by hydroxy groups at positions 2, 4, 6, 3 and 4 respectively. It has been isolated from Alphitonia excelsa.
Dihydromorin
Dihydromorin is a natural product found in Broussonetia papyrifera, Artocarpus altilis, and other organisms with data available.
1-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carbohydrazide
C11H8ClF3N4O (304.03387039999996)
Delorazepam
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants
8-Chloro-3-(4-hydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
C15H9ClO5 (304.01384939999997)
4-Chlorophenol glucuronide|O1-(4-Chlor-phenyl)-beta-D-glucopyranuronsaeure|O1-(4-chloro-phenyl)-beta-D-glucopyranuronic acid|p-Chlor-phenyl-beta-D-glucopyranosiduronsaeure|p-chlorophenyl glucuronide
2鈥樎封€樎?Acetoxy-5-Acetyl-5?脣-(1-propynyl)-2,2?脣-bithiophene
2-Hydroxy-8-(3,4-dihydroxyphenyl)-1H-phenalen-1-one
2-(cis-1,2-dihydroxy-4-oxo-cyclohex-5-enyl)-5,7-dihydroxychromone
(S)-2-(2-oxo-1,2-dihydroquinoline-4-carboxamido)succinic acid
(R)-3-(allylthio)-2-((R)-3-(allylthio)-2-aminopropanamido)propanoic acid
C12H20N2O3S2 (304.09152900000004)
2,5,6-trihydroxy-7-phenylphenalen-1-one|2,5,6-trihydroxy-9-phenylphenalen-1-one|lachnanthoside aglycone
2,3,7,8-tetrahydroxy[1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione|ellagic acid
1,7-Dimethoxy-2,3,8-trihydroxyxanthon|2,3,8-trihydroxy-1,7-dimethoxy-xanthen-9-one
Corymbiferin
Corymbiferin is a natural product found in Gentiana orbicularis, Gentianopsis barbata, and other organisms with data available.
2-(3,4-Dihydroxy-phenyl)-2,5,7-trihydroxy-chroman-3-on|2-(3,4-dihydroxy-phenyl)-2,5,7-trihydroxy-chroman-3-one
3-Methyl-5,10-dihydroxy-7-methoxy-3,4-dihydro-1H-naphtho[2,3-c]pyran-1,6,9-trione
2-O-(4-hydroxybenzoyl)-2,4,6-trihydroxyphenylacetic acid
5-Methoxy-7-phenyl-1H,6H-naphtho[1,8-cd]pyran-1,6-dione
globosuxanthone A
A member of the class of xanthones that is methyl 9-oxo-2,9-dihydro-1H-xanthene-1-carboxylate substituted by hydroxy groups at positions 1, 2 and 8 (the 1R,2R stereoisomer). Isolated from Chaetomium globosum, it exhibits cytotoxicity towards human tumour cell lines.
1-(3,4-dihydro xyphenyl)-3-(2,4,6-trihydroxyphenyl)-1,3-propanedione
(-)-Taxifolin
(-)-taxifolin is the (2S,3S)-stereoisomer of taxifolin. It is an enantiomer of a (+)-taxifolin. (-)-Taxifolin is a natural product found in Acer mandshuricum, Artabotrys hexapetalus, and Bauhinia purpurea with data available. The (2S,3S)-stereoisomer of taxifolin.
2,3-Dihydro-2-hydroxyprotoapigenone
Thymidine-3,5-cyclic monophosphate
Acquisition and generation of the data is financially supported in part by CREST/JST.
Taxifolin
A pentahydroxyflavanone that is the 2,3-dihydro derivative of quercetin. D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents Origin: Plant; Formula(Parent): C15H12O7; Bottle Name:(+-)-Taxifolin; PRIME Parent Name:Dihydroquercetin; PRIME in-house No.:S0088, Pyrans relative retention time with respect to 9-anthracene Carboxylic Acid is 0.594 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.596 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.590 Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2]. Taxifolin ((+)-Dihydroquercetin) exhibits important anti-tyrosinase activity. Taxifolin exhibits significant inhibitory activity against collagenase with an IC50 value of 193.3 μM[1]. Taxifolin is an important natural compound with antifibrotic activity. Taxifolin is a free radical scavenger with antioxidant capacity[2].
(2R,3R)-2-(2,6-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one
(2R,3R)-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydrochromen-4-one
8-hydroxy-7-methoxy-3-methyl-10-oxo-1H-pyrano[4,3-b]chromene-9-carboxylic acid
1,3,8-trihydroxy-4,5-dimethoxyxanthen-9-one
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one
(2R,3R)-2-(2,6-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one
Amiprofos methyl
C11H17N2O4PS (304.06466120000005)
CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4632; ORIGINAL_PRECURSOR_SCAN_NO 4630 INTERNAL_ID 1274; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4619; ORIGINAL_PRECURSOR_SCAN_NO 4614 CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4619; ORIGINAL_PRECURSOR_SCAN_NO 4614 CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4605; ORIGINAL_PRECURSOR_SCAN_NO 4602 CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4633; ORIGINAL_PRECURSOR_SCAN_NO 4630 CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4634; ORIGINAL_PRECURSOR_SCAN_NO 4631 CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9378; ORIGINAL_PRECURSOR_SCAN_NO 9374 CONFIDENCE standard compound; INTERNAL_ID 1274; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9386; ORIGINAL_PRECURSOR_SCAN_NO 9384
(2R,3R)-2-(2,6-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one_major
2-(4-Methoxyphenyl)naphthalic anhydride
4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one
4-methyl-n-(2-oxo-2,5,6,7-tetrahydro-1h-cyclopenta[b]pyridin-4-yl)benzenesulfonamide
C15H16N2O3S (304.08815860000004)
4-amino-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl 4-methylbenzenesulfonate
C15H16N2O3S (304.08815860000004)
5-cyano-3,4-diphenylthiophene-2-carboxamide
C18H12N2OS (304.06703020000003)
1,4-Pentadien-3-one, 1,5-bis(5-nitro-2-furanyl)- (9CI)
N-(5-bromo-3-methylpyridin-2-yl)-N-methylbenzamide
2,6-Dichloropurine-2-deoxyriboside
C10H10Cl2N4O3 (304.01299300000005)
ethyl 3-(2-carboxy-vinyl)-7-nitro-1h-indole-2-carboxylate
Methyl 2-(bromomethyl)-[1,1-biphenyl]-2-carboxylate
N-(8-AMINO-6-FLUORO-5-METHYL-1-OXO-1,2,3,4-TETRAHYDRONAPHTHALEN-2-YL)-2,2,2-TRIFLUOROACETAMIDE
2-CHLORO-N-(4-DIETHYLSULFAMOYL-PHENYL)-ACETAMIDE
C12H17ClN2O3S (304.06483620000006)
(N-PHENYLAMINOMETHYL)TRIMETHOXYSILANE
C14H10F5P (304.04402500000003)
N-[2-(2-aminoethylamino)ethyl]propane-1,3-diamine,tetrahydrochloride
5-Phenyl-2-(trifluoromethyl)-1H-indole-7-carboxamide
C16H11F3N2O (304.08234319999997)
4,4,5,5-TETRAMETHYL-2-(4-((TRIFLUOROMETHYL)THIO)PHENYL)-1,3,2-DIOXABOROLANE
2-ethylcyclopenta-1,3-diene,titanium(4+),dichloride
tert-butyl N-[2-amino-2-(2,4-dichlorophenyl)ethyl]carbamate
1-CHLORO-4-PROPOXY-9H-THIOXANTHEN-9-ONE
C16H13ClO2S (304.03247480000005)
2-(4-((4-CHLOROPHENYL)SULFONYL)PIPERAZIN-1-YL)ETHANOL
C12H17ClN2O3S (304.06483620000006)
2-(1,3-DIOXOLAN-2-YL)BENZYL PHENYL SULFONE
C16H16O4S (304.07692560000004)
Carbonothioic acid S-(4,6-dimethyl-2-pyrimidinyl) O-[(4-methoxyphenyl)methyl] ester
C15H16N2O3S (304.08815860000004)
1-(4-CHLORO-2,5-DIMETHOXYPHENYL)-2-AMINOPROPANEHCL
7-chloro-5-(2-fluorophenyl)-3-hydroxy-1,3-dihydro-1,4-benzodiazepin-2-one
C15H10ClFN2O2 (304.04148019999997)
n-benzyl-4-nitro-2,1,3-benzoxadiazol-5-amine
C13H9ClN4O3 (304.03631540000003)
2-(4-methoxy-phenyl)-imidazo[1,2-a]pyridine monohydrobromine
Acide spaglumique
C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist
4-[2-(Dimethylamino)ethylaminosulfonyl]-7-chloro-2,1,3-benzoxadiazole
C10H13ClN4O3S (304.03968580000003)
3-(t-Butyldimethylsilyloxy)-4-chloro-2-fluorophenylboronic acid
METHYL 3-(BROMOMETHYL)-[1,1-BIPHENYL]-4-CARBOXYLATE
7-HYDROXY-3-(1-PHENYL-1H-PYRAZOL-4-YL)-CHROMEN-4-ONE
C18H12N2O3 (304.08478820000005)
(2R,3R,4S,5S,6R)-2-[(4-chlorophenyl)methoxy]-6-(hydroxymethyl)tet rahydropyran-3,4,5-triol
6-Hydroxy-benzo[h]chromeno[5,4,3-cde]chromene-5,12-dione
Phosphoric acid, 2-ethylhexyl ester, potassium salt
2-(METHACRYLOYLOXY)ETHYL 1,3-DIOXO-1,3-DIHYDROISOBENZOFURAN-5-CARBOXYLATE
ethyl 3-(2-carboxy-vinyl)-5-nitro-1h-indole-2-carboxylate
N-(5-amino-2-chlorophenyl)-4,4-dimethyl-3-oxovaleramide
4-Chloro-3-cyano-N,N-dimethyl-6-nitro-8-quinolinecarboxamide
C13H9ClN4O3 (304.03631540000003)
N,N-DIETHYL-2-OXO-1,2-DIHYDROBENZO[CD]INDOLE-6-SULFONAMIDE
C15H16N2O3S (304.08815860000004)
2-(1-Benzyl-1H-pyrrol-2-yl)-4,6-dichloro-1,3,5-triazine
ETHYL 2,2-DIMETHYL-3-(4-CHLOROSULFONYLPHENYL)PROPIONATE
C13H17ClO4S (304.05360320000005)
1-(3-PYRIDIN-3-YL-[1,2,4]OXADIAZOL-5-YL)-ETHYLAMINE
[3-(Dibenzo[b,d]thiophen-4-yl)phenyl]boronic acid
C18H13BO2S (304.07292680000006)
7-(2,6-DICHLOROPHENYL)-5-METHYLBENZO[E][1,2,4]TRIAZIN-3-AMINE
2-(4-CHLOROPHENYL)-1,3-BIS(1H-1,2,4-TRIAZOL-1-YL)-2-PROPANOL
4-(3-BUTYLUREIDO)-2-METHYLBENZENESULFONYLCHLORIDE
C12H17ClN2O3S (304.06483620000006)
2-(4-Chlorophenyl)-3-(trifluoromethyl)pyrazole-4-carboxylic acid hydrazide
C11H8ClF3N4O (304.03387039999996)
2-bromo-5-((3,3-difluorocyclobutyl)methoxy)-1,3-dimethylbenzene
C13H15BrF2O (304.02742639999997)
[6-Chloro-4-(2-chlorophenyl)-2-quinazolinyl]methanol
3-(4-tolysulfonyl)-4-aminoacetanilide
C15H16N2O3S (304.08815860000004)
(E)-4-nitro-N-(1-phenyl ethylidene)benzenesulfonaMide
(1R,2R)-1-amino-2-(difluoromethyl)-N-(1-methylcyclopropylsulfonyl)cyclopropanecarboxamide hydrochloride
C9H14F2N2O3S*ClH (304.04599340000004)
(6-phenyldibenzo[b,d]thiophen-4-yl)boronic acid
C18H13BO2S (304.07292680000006)
B-[4-(4-dibenzothienyl)phenyl]-boronic acid
C18H13BO2S (304.07292680000006)
2-(4-dibenzothienyl)phenylboronic acid
C18H13BO2S (304.07292680000006)
1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazole-4-carbonyl chloride
C12H8ClF3N2O2 (304.02263739999995)
2-AMINO-3-(1, 2-DIHYDRO-2-OXO-4-QUINOLYL)PROPIONIC ACID DIHYDROCHLORIDE
C12H14Cl2N2O3 (304.03814339999997)
2,3-dihydro-1-benzofuran-2-ylmethyl 4-methylbenzenesulfonate
C16H16O4S (304.07692560000004)
3,6-BIS(2-CHLOROPHENYL)-1,2-DIHYDRO-1,2,4,5-TETRAZINE
2-(3-CHLORO-PHENYL)-5-THIOPHEN-2-YL-2H-PYRAZOLE-3-CARBOXYLIC ACID
2,2,3,3,4,4,5,5-octafluoropentyl 2-fluoroprop-2-enoate
4-chloro-N-(3,4-dimethylphenyl)-3-nitrobenzamide
C15H13ClN2O3 (304.06146580000006)
potassium (4-benzyloxy-2-methylphenyl)trifluoroborate
4-BROMO-1-(2-((TERT-BUTYLDIMETHYLSILYL)OXY)ETHYL)-1H-PYRAZOLE
Methyl clofenapate
D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D009676 - Noxae > D000963 - Antimetabolites
3,12-Dioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),4,6,8,15,17,19-heptaene-14,21-dione
N-(1-naphthalenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine
C17H12N4S (304.07826320000004)
Ethyl 5-amino-3-methyl-4-(phenylcarbamoyl)thiophene-2-carboxylate
C15H16N2O3S (304.08815860000004)
N-(6-methyl-2-pyridinyl)-2-(phenylmethyl)sulfonylacetamide
C15H16N2O3S (304.08815860000004)
3-Methyl-7-[(3-methylphenyl)methylthio]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
4H-1-Benzopyran-4-one, 2-(2,6-dihydroxyphenyl)-2,3-dihydro-3,5,7-trihydroxy-, (2R,3R)-
3-(2,6-difluorophenyl)-2-(methylthio)quinazolin-4(3H)-one
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-3'-O-sulphate
C11H12O8S (304.02528720000004)
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-sulphate belongs to the family of Catechols. These are compounds containing a 1,2-benzenediol moiety.
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone-4'-O-sulphate
C11H12O8S (304.02528720000004)
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-sulphate belongs to the family of Resorcinols. These are compounds containing a resorcinol moiety, which is a benzene ring bearing two hydrocyl groups at positions 1 and 3.
3,5-cyclic CMP(1-)
The conjugate base of 3,5-cyclic CMP; major species at pH 7.3.
4-(5-O-phosphonato-beta-D-ribofuranosyl)phenol(2-)
N-(4-oxoglutaryl)-L-cysteinylglycine
C10H12N2O7S-2 (304.03652020000004)
{3-oxo-2-[(2Z)-5-(sulfonatooxy)pent-2-en-1-yl]cyclopentyl}acetate
(3R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one
(4S)-2-(3,4-dihydroxyphenyl)-4H-1-benzopyran-3,4,5,7-tetrol
[4-(5-methylhexanoyl)-5-oxo-2H-furan-3-yl]methyl phosphate
N-Acetyl-1-aspartylglutamic acid
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D009676 - Noxae > D009498 - Neurotoxins D018926 - Anti-Allergic Agents D020011 - Protective Agents
4-Chloro-5-(2,3-dihydro-1,4-benzodioxin-3-yl)thieno[2,3-d]pyrimidine
4-[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)thio]-3-oxobutanoic acid ethyl ester
C15H16N2O3S (304.08815860000004)
N-[(E)-furan-2-ylmethylideneamino]-3,5-dinitrobenzamide
(2R)-2-[[(3S)-3-acetamido-3-carboxy-1-oxopropyl]amino]pentanedioic acid
1-(4-Methylphenyl)sulfonyl-3-methylsulfonylimidazolidine
N-(4-methoxyphenyl)-5-oxo-6,7-dihydro-[1,2,4]triazolo[3,4-b][1,3]thiazine-7-carboxamide
N-[(4-chlorophenyl)-oxomethyl]-2-hydroxy-3-methylbenzohydrazide
C15H13ClN2O3 (304.06146580000006)
5-chloro-N-[(1E,2E)-3-(2-furyl)-1-methylprop-2-enylidene]-2-hydroxybenzohydrazide
C15H13ClN2O3 (304.06146580000006)
2-(2,4-dioxo-3-thiazolidinyl)-N-(2,3,4-trifluorophenyl)acetamide
N-(3-methoxyphenyl)-5-oxo-6,7-dihydro-[1,2,4]triazolo[3,4-b][1,3]thiazine-7-carboxamide
N-(1,3-benzothiazol-2-yl)-2-[(1-methyl-2-imidazolyl)thio]acetamide
2-[[2-(2-Oxo-1,3-dihydroindol-3-yl)acetyl]amino]butanedioate
4-Carboxylato-4-sulfonatoazobenzene
C13H8N2O5S-2 (304.01539180000003)
1-(2,3-Dihydroxy-5-methylphenyl)-2-(2,4,6-trihydroxyphenyl)ethane-1,2-dione
(2R)-2-(3,4-dihydroxyphenyl)-2,5,7-trihydroxy-2,3-dihydro-4H-chromen-4-one
(2S,3S,4R,5R)-6-[(E)-1-chloro-3-ethylpent-1-en-4-yn-3-yl]-3,4,5-trihydroxyoxane-2-carboxylic acid
(5-Hydroxy-7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl) hydrogen sulate
5,7-Dihydroxy-2-(2,3,4-trihydroxyphenyl)-2,3-dihydrochromen-4-one
[4-(2-Phenylcyclobutyl)phenyl] hydrogen sulate
C16H16O4S (304.07692560000004)
8-hydroxy-7-methoxy-3-methyl-10-oxo-1H-pyrano[4,3-b]chromene-9-carboxylic acid
melphalan
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01A - Alkylating agents > L01AA - Nitrogen mustard analogues A phenylalanine derivative comprising L-phenylalanine having [bis(2-chloroethyl)amino group at the 4-position on the phenyl ring. D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D000970 - Antineoplastic Agents > D019653 - Myeloablative Agonists D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Sarcolysin
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D000970 - Antineoplastic Agents > D019653 - Myeloablative Agonists D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000477 - Alkylating Agents
4-(5-O-phosphonato-beta-D-ribofuranosyl)phenol(2-)
An organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of 4-(5-O-phospho-beta-D-ribofuranosyl)phenol; major species at pH 7.3.
Dihydrotricetin
A pentahydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7, 3, 4 and 5.
N-Acetyl-alpha-aspartylglutamic acid
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D009676 - Noxae > D009498 - Neurotoxins D018926 - Anti-Allergic Agents D020011 - Protective Agents
Clozic
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-4-O-sulphate
C11H12O8S (304.02528720000004)
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone-3-O-sulphate
C11H12O8S (304.02528720000004)
Ac-Asp-Glu
A dipeptide composed of N-acetyl-L-aspartic acid and L-glutamic acid joined by a peptide linkage.
2,3-cyclic CMP(1-)
A 2,3-cyclic nucleotide(1-) which is obtained from 2,3-cyclic CMP by removal of a proton from the cyclic phosphate group.
3,5-Cyclic dTMP
A 3,5-cyclic pyrimidine nucleotide derived from thymidine monophosphate.
(2s)-2-{[hydroxy(2-hydroxyquinolin-4-yl)methylidene]amino}butanedioic acid
(2r,3s)-3-(3,4-dihydroxyphenyl)-2,6,8-trihydroxy-2,3-dihydro-1-benzopyran-4-one
7-hydroxy-8-methoxy-3-methyl-10-oxo-1h-pyrano[4,3-b]chromene-9-carboxylic acid
2-hydroxy-8-methoxy-12-methyl-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1(9),2,7,11(15)-tetraene-10,16-dione
(2e)-3-(2,3,4-trihydroxyphenyl)-1-(2,3,6-trihydroxyphenyl)prop-2-en-1-one
2-(3,4-dihydroxyphenyl)-4,6-dihydroxy-2-methoxy-1-benzofuran-3-one
(1r,3s,4s,6r,7s,8r)-3-(chloromethyl)-6-hydroxy-8-methoxy-10-methylidene-2,9-dioxatricyclo[4.3.1.0³,⁷]decan-4-yl acetate
(12bs)-10-bromo-1h,2h,3h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine
2-chloro-1,6,8-trihydroxy-3-methylanthracene-9,10-dione
C15H9ClO5 (304.01384939999997)
2-(2,5-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one
2-(2,4-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one
(12s)-8-hydroxy-2-methoxy-12-methyl-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1(9),2,7,11(15)-tetraene-10,16-dione
8-hydroxy-9-methoxy-2-methyl-4-oxo-5h-pyrano[3,2-c]chromene-10-carboxylic acid
2-(1,6-dihydroxy-4-oxocyclohex-2-en-1-yl)-5,7-dihydroxychromen-4-one
7-bromo-3-(2-imino-1h-pyrimidin-4-yl)-1h-indol-4-ol
methyl 5,8-dihydroxy-2-methyl-4,9-dioxo-2h,3h-naphtho[2,3-b]furan-7-carboxylate
1,5,10-trihydroxy-7-methoxy-3-methyl-1h-cyclohexa[g]isochromene-6,9-dione
(1s,2r,10r)-2,4-dihydroxy-6-methoxy-12-methyl-11,15-dioxatetracyclo[8.4.1.0¹,¹⁰.0³,⁸]pentadeca-3,5,7,12-tetraene-9,14-dione
3-(3,4-dihydroxyphenyl)-2,6,8-trihydroxy-2,3-dihydro-1-benzopyran-4-one
1,3,7-trihydroxy-4,8-dimethoxyxanthone
{"Ingredient_id": "HBIN001112","Ingredient_name": "1,3,7-trihydroxy-4,8-dimethoxyxanthone","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "COC1=C(C=CC2=C1C(=O)C3=C(C(=C(C=C3O2)O)OC)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41917","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-cis-dihydroquercetin
{"Ingredient_id": "HBIN003952","Ingredient_name": "2,3-cis-dihydroquercetin","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40771","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-trans-dihydroquercetin
{"Ingredient_id": "HBIN004177","Ingredient_name": "2,3-trans-dihydroquercetin","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40757","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3β- dihydroguercetin
{"Ingredient_id": "HBIN005220","Ingredient_name": "2\u03b1,3\u03b2- dihydroguercetin","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42700","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3β- dihydroquercetin
{"Ingredient_id": "HBIN005222","Ingredient_name": "2\u03b1,3\u03b2- dihydroquercetin","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42699","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-o-(4-hydroxybenzoyl)-2,4,6-trihydroxy-phenylaceticacid
{"Ingredient_id": "HBIN006167","Ingredient_name": "2-o-(4-hydroxybenzoyl)-2,4,6-trihydroxy-phenylaceticacid","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9829","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(+)-3,3',5',5,7-pentahydroflavanone
{"Ingredient_id": "HBIN007139","Ingredient_name": "(+)-3,3',5',5,7-pentahydroflavanone","Alias": "AC1NSZI8; (2R,3R)-2-(3,5-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one; CHEMBL3634574","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=C(C=C(C=C1O)O)C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O","Ingredient_weight": "304.25 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT18840","TCMID_id": "25360","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5320468","DrugBank_id": "NA"}
3,3',5,5',7-pentahydroxyflavanone
{"Ingredient_id": "HBIN007141","Ingredient_name": "3,3',5,5',7-pentahydroxyflavanone","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=CC(=C(C=C1C2C(=O)C(C3=C(C=C(C=C3O2)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42006","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,5,7,2',6'-pentahydroxy flavanonol
{"Ingredient_id": "HBIN007564","Ingredient_name": "3,5,7,2',6'-pentahydroxy flavanonol","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "COC1=CC(=C2C(=C1)OC3=CC(=C(C(=C3C2=O)O)OC)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31764","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(+)-3,5,7,3',5'-pentahydroxyflavanone
{"Ingredient_id": "HBIN007568","Ingredient_name": "(+)-3,5,7,3',5'-pentahydroxyflavanone","Alias": "NA","Ingredient_formula": "C15H12O7","Ingredient_Smile": "C1=C(C=C(C=C1O)O)C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O","Ingredient_weight": "304.25 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16834","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "25073455","DrugBank_id": "NA"}
5,8-dihydroxy-1-[(1s)-1-hydroxyethyl]-7-methoxynaphtho[2,3-c]furan-4,9-dione
methyl 6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-carboxylate
8-chloro-5,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one
C15H9ClO5 (304.01384939999997)
8-hydroxy-7-methoxy-3-methyl-10-oxo-1h-pyrano[4,3-b]chromene-6-carboxylic acid
(12s)-2-hydroxy-8-methoxy-12-methyl-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1(9),2,7,11(15)-tetraene-10,16-dione
{6,10-dihydroxy-12-methoxy-4-oxo-3-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),5(13),6,8,10-pentaen-8-yl}methyl formate
(1r,3s,4s,6r,7s,8s)-3-(chloromethyl)-6-hydroxy-8-methoxy-10-methylidene-2,9-dioxatricyclo[4.3.1.0³,⁷]decan-4-yl acetate
methyl 4,9-dihydroxy-2-methyl-5,8-dioxo-2h,3h-naphtho[2,3-b]furan-7-carboxylate
3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
3-(7-hydroxy-2h-chromen-3-yl)-4-oxohex-2-enedioic acid
methyl 2-chloro-3-(4-hydroxy-3,5-dinitrophenyl)propanoate
C10H9ClN2O7 (304.00982739999995)
2-(3,4-dihydroxyphenyl)-3,6,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one
(2r,3r)-2-(3,4-dihydroxyphenyl)-3,7,8-trihydroxy-2,3-dihydro-1-benzopyran-4-one
(2r,3s)-2-(3,4-dihydroxyphenyl)-3,7,8-trihydroxy-2,3-dihydro-1-benzopyran-4-one
2-(3,5-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one
4-hydroxy-1-{2-hydroxy-2-oxo-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl}-5-methylpyrimidin-2-one
(2s)-2-[(3,4-dihydroxyphenyl)methyl]-2,4,6-trihydroxy-1-benzofuran-3-one
1-[(4ar,6r,7as)-2-hydroxy-2-oxo-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-4-hydroxy-5-methylpyrimidin-2-one
methyl 3-hydroxy-2-[(2e)-7-oxo-3h-[1,4]dioxino[2,3-g]chromen-2-ylidene]propanoate
(2s,3r)-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
(2r,3r)-3,5,7,8-tetrahydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
8-chloro-3-(3,4-dihydroxyphenyl)-7-hydroxychromen-4-one
C15H9ClO5 (304.01384939999997)
6-bromo-3-(2-imino-1h-pyrimidin-4-yl)-1h-indol-4-ol
(2r,3r)-2-(2,5-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one
5,8-dihydroxy-1-[(1r)-1-hydroxyethyl]-7-methoxynaphtho[2,3-c]furan-4,9-dione
(2r,3r)-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
4-methoxy-5-phenyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2(7),4,9,11-pentaene-3,6-dione
(4as,8as)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4a,8a-dihydrochromen-4-one
2,3,3,5,6-pentahydroxy-2-phenyl-1-benzopyran-4-one
2-(hydroxymethyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pyran-4-one
2-(3,4-dihydroxyphenyl)-3,7,8-trihydroxy-2,3-dihydro-1-benzopyran-4-one
2-(2,6-dihydroxy-4-methylbenzoyl)-3,5-dihydroxybenzoic acid
2-oxo-2-[5'-(prop-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]ethyl acetate
2-{[hydroxy(2-hydroxyquinolin-4-yl)methylidene]amino}butanedioic acid
1-chloro-2,4,5-trihydroxy-7-methylanthracene-9,10-dione
C15H9ClO5 (304.01384939999997)