Exact Mass: 240.0432284
Exact Mass Matches: 240.0432284
Found 500 metabolites which its exact mass value is equals to given mass value 240.0432284,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Alizarin
COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8028 Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
L-Cystine
Cystine is an oxidized dimeric form of cysteine. It is formed by linking two cysteine residues via a disulfide bond (Cys-S-S-Cys) between the -SH groups. Cystine is found in high concentrations in digestive enzymes and in the cells of the immune system, skeletal and connective tissues, skin, and hair. Hair and skin are 10-14\\\% cystine. Cystine is the preferred form of cysteine for the synthesis of glutathione in cells involved in the immune system (e.g. macrophages and astrocytes). Lymphocytes and neurons prefer cysteine for glutathione production. Optimizing glutathione levels in macrophages and astrocytes with cystine allows these cells to provide cysteine to lymphocytes and neurons directly upon demand (Wikipedia). (-)-Cystine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=56-89-3 (retrieved 2024-06-29) (CAS RN: 56-89-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
(±)-2-(1-Methylpropyl)-4,6-dinitrophenol
C10H12N2O5 (240.07461819999997)
CONFIDENCE standard compound; INTERNAL_ID 838; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5273; ORIGINAL_PRECURSOR_SCAN_NO 5272 CONFIDENCE standard compound; INTERNAL_ID 838; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5303; ORIGINAL_PRECURSOR_SCAN_NO 5302 CONFIDENCE standard compound; INTERNAL_ID 838; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5259; ORIGINAL_PRECURSOR_SCAN_NO 5256 CONFIDENCE standard compound; INTERNAL_ID 838; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4695; ORIGINAL_PRECURSOR_SCAN_NO 4691 CONFIDENCE standard compound; INTERNAL_ID 838; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4674; ORIGINAL_PRECURSOR_SCAN_NO 4673 CONFIDENCE standard compound; INTERNAL_ID 838; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5235; ORIGINAL_PRECURSOR_SCAN_NO 5234 D010575 - Pesticides > D005659 - Fungicides, Industrial > D004140 - Dinitrophenols CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8186 CONFIDENCE standard compound; EAWAG_UCHEM_ID 257 CONFIDENCE standard compound; INTERNAL_ID 2330 D010575 - Pesticides > D007306 - Insecticides D010575 - Pesticides > D006540 - Herbicides Acaricide and weed kille D016573 - Agrochemicals
DINOTERB
C10H12N2O5 (240.07461819999997)
D010575 - Pesticides > D005659 - Fungicides, Industrial > D004140 - Dinitrophenols CONFIDENCE standard compound; EAWAG_UCHEM_ID 3109 CONFIDENCE standard compound; INTERNAL_ID 915; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5259; ORIGINAL_PRECURSOR_SCAN_NO 5256 CONFIDENCE standard compound; INTERNAL_ID 915; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5260; ORIGINAL_PRECURSOR_SCAN_NO 5259 CONFIDENCE standard compound; INTERNAL_ID 915; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4808; ORIGINAL_PRECURSOR_SCAN_NO 4806 CONFIDENCE standard compound; INTERNAL_ID 915; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5303; ORIGINAL_PRECURSOR_SCAN_NO 5302 CONFIDENCE standard compound; INTERNAL_ID 915; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5235; ORIGINAL_PRECURSOR_SCAN_NO 5234 CONFIDENCE standard compound; INTERNAL_ID 915; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5273; ORIGINAL_PRECURSOR_SCAN_NO 5272
Dantron
Danthron is an orange crystalline powder. Almost odorless and tasteless. (NTP, 1992) Chrysazin is a dihydroxyanthraquinone that is anthracene-9,10-dione substituted by hydroxy groups at positions 1 and 8. It has a role as an apoptosis inducer and a plant metabolite. Withdrawn from the Canadian, US, and UK markets in 1998 due to genotoxicity. Danthron is a natural product found in Didemnum albopunctatum, Asphodelus tenuifolius, and other organisms with data available. Danthron is a reddish, synthetic anthraquinone derivative. Danthron has been widely used as a laxative, but is no longer used to treat constipation and is currently used as an antioxidant in synthetic lubricants, in the synthesis of experimental antitumor agents, as a fungicide and as an intermediate for making dyes. This substance is a suspected mutagen and is reasonably anticipated to be a human carcinogen based on evidence of carcinogenicity in experimental animals. (NCI05) A - Alimentary tract and metabolism > A06 - Drugs for constipation > A06A - Drugs for constipation > A06AB - Contact laxatives A dihydroxyanthraquinone that is anthracene-9,10-dione substituted by hydroxy groups at positions 1 and 8. Dantron is found in green vegetables. Dantron occurs in roots of Rheum palmatum (Turkey rhubarb Occurs in roots of Rheum palmatum (Turkey rhubarb). Dantron is found in green vegetables. D005765 - Gastrointestinal Agents > D002400 - Cathartics D009676 - Noxae > D009153 - Mutagens [Raw Data] CB120_Laxapur_neg_20eV_000028.txt [Raw Data] CB120_Laxapur_neg_40eV_000028.txt [Raw Data] CB120_Laxapur_neg_30eV_000028.txt [Raw Data] CB120_Laxapur_neg_10eV_000028.txt [Raw Data] CB120_Laxapur_neg_50eV_000028.txt Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK. Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK. Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK.
Bentazone
CONFIDENCE standard compound; INTERNAL_ID 1204; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3883; ORIGINAL_PRECURSOR_SCAN_NO 3880 CONFIDENCE standard compound; INTERNAL_ID 1204; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3853; ORIGINAL_PRECURSOR_SCAN_NO 3852 CONFIDENCE standard compound; INTERNAL_ID 1204; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3872; ORIGINAL_PRECURSOR_SCAN_NO 3871 CONFIDENCE standard compound; INTERNAL_ID 1204; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3882; ORIGINAL_PRECURSOR_SCAN_NO 3878 CONFIDENCE standard compound; INTERNAL_ID 1204; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3897; ORIGINAL_PRECURSOR_SCAN_NO 3895 CONFIDENCE standard compound; INTERNAL_ID 1204; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3872; ORIGINAL_PRECURSOR_SCAN_NO 3868 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8380 CONFIDENCE standard compound; EAWAG_UCHEM_ID 253 CONFIDENCE standard compound; INTERNAL_ID 2313 CONFIDENCE standard compound; INTERNAL_ID 3258 D010575 - Pesticides > D006540 - Herbicides KEIO_ID B072; [MS2] KO008894 D016573 - Agrochemicals KEIO_ID B072
Anthraflavin
A dihydroxyanthraquinone that is anthracene substituted by hydroxy groups at C-3 and C-7 and oxo groups at C-9 and C-10. CONFIDENCE standard compound; INTERNAL_ID 8171
UNII:5K6L8O868Y
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.976 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.978 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.974 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.973 4'-Hydroxyflavanone is an inhibitor of SREBP maturation and lipid synthesis. 4'-Hydroxyflavanone is a synthetic analogue of flavanone, has potential for hepatic steatosis and dyslipidemia research[1]. 4'-Hydroxyflavanone is an inhibitor of SREBP maturation and lipid synthesis. 4'-Hydroxyflavanone is a synthetic analogue of flavanone, has potential for hepatic steatosis and dyslipidemia research[1]. 4'-Hydroxyflavanone is an inhibitor of SREBP maturation and lipid synthesis. 4'-Hydroxyflavanone is a synthetic analogue of flavanone, has potential for hepatic steatosis and dyslipidemia research[1].
6-Hydroxyflavanone
A monohydroxyflavanone that is flavanone substituted by a hydroxy group at position 6. Annotation level-1
(1R,6R)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate
(1r,6r)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate, also known as shchc, belongs to gamma-keto acids and derivatives class of compounds. Those are organic compounds containing an aldehyde substituted with a keto group on the C4 carbon atom (1r,6r)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate is slightly soluble (in water) and a weakly acidic compound (based on its pKa). (1r,6r)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate can be found in a number of food items such as kiwi, muskmelon, purple laver, and lima bean, which makes (1r,6r)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate a potential biomarker for the consumption of these food products (1r,6r)-6-hydroxy-2-succinylcyclohexa-2,4-diene-1-carboxylate may be a unique E.coli metabolite.
Chrysophanol-9-anthrone
Chrysophanol-9-anthrone, also known as chrysarobin or chrysothrone, is a member of the class of compounds known as anthracenes. Anthracenes are organic compounds containing a system of three linearly fused benzene rings. Thus, chrysophanol-9-anthrone is considered to be an aromatic polyketide lipid molecule. Chrysophanol-9-anthrone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Chrysophanol-9-anthrone can be found in sorrel, which makes chrysophanol-9-anthrone a potential biomarker for the consumption of this food product. C254 - Anti-Infective Agent > C514 - Antifungal Agent
Acetylatractylodinol
Acetylatractylodinol, isolated from Atractylodes lancea, possesses antioxidant activity[1]. Acetylatractylodinol is a click chemistry reagent, itcontains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups. Acetylatractylodinol, isolated from Atractylodes lancea, possesses antioxidant activity[1]. Acetylatractylodinol is a click chemistry reagent, itcontains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
4'-Hydroxyflavanone
4'-Hydroxyflavanone is an inhibitor of SREBP maturation and lipid synthesis. 4'-Hydroxyflavanone is a synthetic analogue of flavanone, has potential for hepatic steatosis and dyslipidemia research[1]. 4'-Hydroxyflavanone is an inhibitor of SREBP maturation and lipid synthesis. 4'-Hydroxyflavanone is a synthetic analogue of flavanone, has potential for hepatic steatosis and dyslipidemia research[1]. 4'-Hydroxyflavanone is an inhibitor of SREBP maturation and lipid synthesis. 4'-Hydroxyflavanone is a synthetic analogue of flavanone, has potential for hepatic steatosis and dyslipidemia research[1].
Cystine
C6H12N2O4S2 (240.02384719999998)
Flavouring ingredient. (±)-Cystine is found in many foods, some of which are green bell pepper, green zucchini, italian sweet red pepper, and red bell pepper.
Levamisole hydrochloride
C308 - Immunotherapeutic Agent > C210 - Immunoadjuvant > C2141 - Chemo Immunostimulant Adjuvant D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics D018501 - Antirheumatic Agents D007155 - Immunologic Factors C2140 - Adjuvant
o-Hydroxydibenzoylmethane
Origin: Plant, Dibenzoylmethanes
Alizarin
Alizarin is a dihydroxyanthraquinone that is anthracene-9,10-dione in which the two hydroxy groups are located at positions 1 and 2. It has a role as a chromophore, a dye and a plant metabolite. Alizarin is a natural product found in Oldenlandia umbellata, Rubia alata, and other organisms with data available. See also: Rubia tinctorum root (part of). A dihydroxyanthraquinone that is anthracene-9,10-dione in which the two hydroxy groups are located at positions 1 and 2.
1,4-Dihydroxyanthraquinone
Quinizarin is a dihydroxyanthraquinone having the two hydroxy substituents at the 1- and 4-positions; formally derived from anthraquinone by replacement of two hydrogen atoms by hydroxy groups It has a role as a dye. 1,4-Dihydroxyanthraquinone is a natural product found in Rubia tinctorum and Senna obtusifolia with data available. See also: Rubia tinctorum root (part of).
Xanthopurpurin
Xanthopurpurin is a dihydroxyanthraquinone. It has a role as a metabolite. Xanthopurpurin is a natural product found in Galium spurium, Rubia argyi, and other organisms with data available. See also: Rubia tinctorum root (part of). obtained from Asperula odorata (sweet wooddruff). Xanthopurpurin is found in tea, herbs and spices, and beverages. Xanthopurpurin is found in beverages. Xanthopurpurin is obtained from Asperula odorata (sweet wooddruff
2',5'-Dihydroxychalcone
2,5-Dihydroxychalcone is an antioxidant for edible oils and fat
2,4-Dihydroxychalcone
2,4-Dihydroxychalcone is found in fruits. 2,4-Dihydroxychalcone is a constituent of the fruit of Litchi chinensis (lychee). Constituent of the fruit of Litchi chinensis (lychee). 2,4-Dihydroxychalcone is found in fruits.
Lettucenin A
Phytoalexin from Lactuca sativa variety capitata (head lettuce). Lettucenin A is found in lettuce and romaine lettuce. Lettucenin A is found in lettuce. Phytoalexin from Lactuca sativa var. capitata (head lettuce).
3',4'-Dihydroxychalcone
3,4-Dihydroxychalcone is an antioxidant for edible oils and fat
Propyl 1-(propylsulfinyl)propyl disulfide
Propyl 1-(propylsulfinyl)propyl disulfide is found in onion-family vegetables. Propyl 1-(propylsulfinyl)propyl disulfide is a constituent of Allium tricoccum (wood leek). Constituent of Allium tricoccum (wood leek). Propyl 1-(propylsulfinyl)propyl disulfide is found in onion-family vegetables.
4-(1,3-Benzothiazol-2-yl)-2-methylaniline
C14H12N2S (240.07211519999998)
Doqualast
C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent
Fluindione
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AA - Vitamin k antagonists C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent D006401 - Hematologic Agents > D000925 - Anticoagulants
Idronoxil
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C1748 - Topoisomerase Inhibitor
3,8-Dichloro-6-chloromethyl-2-methyl-1,6-octadiene
Napabucasin
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor
1,8-Dichloro-6-chloromethyl-2-methyl-2,6-octadiene
2,4-Dihydroxychalcone
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.137 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.136 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.140
Pyridoxamine dihydrochloride
A hydrochloride obtained by combining pyridoxamine with two molar equivalents of hydrochloric acid. Used for treatment of diabetic nephropathy. Pyridoxylamine dihydrochloride is an advanced glycation end production (AGEs) and lipoxidation end products (ALEs) inhibitor, to protect against diabetes-induced retinal vascular lesions[1].
1-(2-Hydroxy-phenyl)-3-phenyl-propan-1,2-dion|1-(2-hydroxy-phenyl)-3-phenyl-propane-1,2-dione|1-(2-hydroxyphenyl)-3-phenylpropane-1,2-dione|2,beta-dihydroxychalcone
methyl beta-(2-hydroxy-4-carboxy)phenyllactate|Thevefolic acid A
4-acetoxy-2-acetoxymethyl-5,6-epoxy-cyclohex-2-enone
2-Formyl-4-hydroxy-3-hydroxymethyl-6-methoxy-5-methylbenzoic acid
1-Ac-(Z)-7-(3-Hydroxyphenyl)-2-phenyl-4,6-diyn-1-ol|cis-7-(m-Hydroxy-phenyl)-hepten-(2)-diin-(4,6)-yl-acetat|cis-7--hepten-(2)-diin-(4,6)-yl-acetat
3-(2-hydroxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
1H-2-Benzopyran-1-one, 5-chloro-8-hydroxy-6-methoxy-3-methyl-
C11H9ClO4 (240.01893439999998)
2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic Acid
(3S,5R,6E)-3,5,8-trichloro-2,6-dimethyl-octa-1,6-diene
6-hydroxyphenazine-1-carboxylic acid
A member of the class of phenazines that is phenazine substituted by a carboxy group at positions 1 and a hydroxy group at position 6. A natural product found in Streptomyces sp. IFM 11204.
7-chloro-8-hydroxy-6-methoxy-3-methylisocoumarin
C11H9ClO4 (240.01893439999998)
1,4-DPCA
1,4-DPCA, a potent prolyl-4-hydroxylase inhibitor, is a collagen hydroxylation inhibitor in human foreskin fibroblasts with an IC50 of 2.4 μM. 1,4-DPCA inhibits prolyl-4-hydroxylases α isoforms stabilizes HIF-1α protein. 1,4-DPCA also inhibits factor inhibiting HIF (FIH) with an IC50 of 60 μM[1][2].
Cystine
C6H12N2O4S2 (240.02384719999998)
A sulfur-containing amino acid obtained by the oxidation of two cysteine molecules which are then linked via a disulfide bond. Acquisition and generation of the data is financially supported by the Max-Planck-Society
4,6-dihydroxy-3-(1-hydroxyethyl)-5-methoxy-3H-2-benzofuran-1-one
1,3-Dihydroxyanthraquinone
CONFIDENCE standard compound; INTERNAL_ID 8277
L-Cystine
C6H12N2O4S2 (240.02384719999998)
The L-enantiomer of the sulfur-containing amino acid cystine.
C11H12O6_(3R,4S)-4,6,8-Trihydroxy-7-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one
Alizarin
COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
4,6-dihydroxy-3-(1-hydroxyethyl)-5-methoxy-3H-2-benzofuran-1-one
4,6,8-trihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
Danthron
A - Alimentary tract and metabolism > A06 - Drugs for constipation > A06A - Drugs for constipation > A06AB - Contact laxatives D005765 - Gastrointestinal Agents > D002400 - Cathartics D009676 - Noxae > D009153 - Mutagens Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK. Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK. Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK.
(3R,4S)-4,6,8-trihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
2-Hydroxyphenanzine-1-Carboxylic acid
CONFIDENCE standard compound; INTERNAL_ID 188
Fluindione
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AA - Vitamin k antagonists C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent D006401 - Hematologic Agents > D000925 - Anticoagulants
4,6-dihydroxy-3-(1-hydroxyethyl)-5-methoxy-3H-2-benzofuran-1-one_major
4,6-Dihydroxy-3-(1-hydroxyethyl)-5-methoxy-2-benzofuran-1(3H)-one
4,6,8-Trihydroxy-7-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one
4-(3-Chloro-4-methoxyphenyl)-1,3-thiazol-2-amine
C10H9ClN2OS (240.01240939999997)
5-CHLORO-7-(PYRIDIN-4-YL)QUINOLINE
C14H9ClN2 (240.04542239999998)
8-Quinolinesulfonic acid,5-amino-6-hydroxy-
C9H8N2O4S (240.02047679999998)
4-(2-chloro-1,1,2-trifluoroethoxy)-2-methylphenol
C9H8ClF3O2 (240.01648939999998)
Ethanone,2-bromo-1-(2,4,6-trimethylphenyl)-
C11H13BrO (240.01497080000001)
Methyl 4-(4-chlorophenyl)-2,4-dioxobutanoate
C11H9ClO4 (240.01893439999998)
N-[4-[acetyl(methyl)amino]phenyl]-2-chloroacetamide
C11H13ClN2O2 (240.06655080000002)
1-(4-METHYLSULFANYLPHENYL)-1H-BENZOIMIDAZOLE
C14H12N2S (240.07211519999998)
3-Chloro-4-piperazinobenzoic Acid
C11H13ClN2O2 (240.06655080000002)
3-(2,2,2-Trimethylhydrazinyl)-propanoic acid methyl ester bromide
ETHYL 2-CHLORO-2-[2-(2-METHYLPHENYL)HYDRAZONO]-ACETATE
C11H13ClN2O2 (240.06655080000002)
5-CHLOROMETHYL-3-(4-METHYLSULFANYL-PHENYL)-[1,2,4]OXADIAZOLE
C10H9ClN2OS (240.01240939999997)
N-(BENZO[D]THIAZOL-6-YL)-3-CHLOROPROPANAMIDE
C10H9ClN2OS (240.01240939999997)
5-bromo-2,2-dimethyl-3,4-dihydro-2H-chroMene
C11H13BrO (240.01497080000001)
3-HYDROXY-7-METHOXY-2-NAPHTHOIC ACID SODIUM SALT
C12H9NaO4 (240.03985139999998)
Acetic acid,2,2-[(4-methyl-1,2-phenylene)bis(oxy)]bis- (9CI)
(1S,3S,5S)-2-AZABICYCLO[3.1.0]HEXANE-3-CARBOXAMIDE 2,2,2-TRIFLUOROACETATE
C8H11F3N2O3 (240.07217319999998)
7H-Spiro[furo[3,4-b]pyridine-5,4-piperidin]-7-one hydrochloride
C11H13ClN2O2 (240.06655080000002)
ETHYL 2-AMINO-4-(TRIFLUOROMETHYL)THIAZOLE-5-CARBOXYLATE
C7H7F3N2O2S (240.01803180000002)
(6R,7R)-7-Amino-8-oxo-3-(1-propenyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
(r)-3-amino-4-(4-cyanophenyl)butanoic acid hydrochloride
C11H13ClN2O2 (240.06655080000002)
N-(6-Chloro-3-formylpyridin-2-yl)pivalamide
C11H13ClN2O2 (240.06655080000002)
3-(Trifluoromethoxy)benzimidamide(HCl)
C8H8ClF3N2O (240.02772239999996)
4,5-Diamino-1-(2-hydroxyethyl)pyrazole sulfate
C5H12N4O5S (240.05283819999997)
3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine
1-(5-Chloro-2-nitrophenyl)piperidine
C11H13ClN2O2 (240.06655080000002)
1-(6-chloropyridazin-3-yl)piperidine-4-carboxamide
(s)-3-amino-4-(2-cyanophenyl)butanoic acid hydrochloride
C11H13ClN2O2 (240.06655080000002)
Benzenemethanol,4-bromo-a-cyclopropyl-a-methyl-
C11H13BrO (240.01497080000001)
1-(4-Bromophenyl)-2,2-dimethyl-1-propanone
C11H13BrO (240.01497080000001)
2-CHLORO-N-[(ETHYLAMINO)CARBONYL]-2-PHENYLACETAMIDE
C11H13ClN2O2 (240.06655080000002)
3-(2-phenylethenylsulfonyl)propanoic acid
C11H12O4S (240.04562719999998)
5-Bromo-2-(piperidin-1-yl)pyridine
C10H13BrN2 (240.02620380000002)
5-CHLORO-4-(CHLOROMETHYL)-3-METHYL-1-PHENYL-1H-PYRAZOLE
C11H10Cl2N2 (240.02210000000002)
Thieno[2,3-b]pyrazine-6-carboxylic acid,7-ethyl-1,2,3,4-tetrahydro-2,3-dioxo-
C9H8N2O4S (240.02047679999998)
4,8-DICHLORO-2-ISOPROPYL-QUINAZOLINE
C11H10Cl2N2 (240.02210000000002)
1-[4-(bromomethyl)phenyl]-2-methylpropan-1-one
C11H13BrO (240.01497080000001)
6-fluoro-4-(trifluoromethyl)quinoline-2-carbonitrile
3-OXO-2-(THIOPHENE-2-CARBONYL)BUTYRIC ACID ETHYL ESTER
C11H12O4S (240.04562719999998)
2-(4-fluorophenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
C14H9FN2O (240.06988759999996)
Idazoxan Hydrochloride
C11H13ClN2O2 (240.06655080000002)
Idazoxan hydrochloride (RX 781094 hydrochloride) is an α2-adrenoceptor antagonist and is also a imidazoline receptors (IRs) antagonist competitively antagonized the centrally induced hypotensive effect of imidazoline-like agents (IMs). Idazoxan hydrochloride also improves motor symptoms in Parkinson’s disease, L-DOPA-induced dyskinesias, and experimental Parkinsonism[1][2].
4,7-Dioxo-7-thiophen-2-yl-heptanoic acid
C11H12O4S (240.04562719999998)
Tetramisole hydrochloride
C308 - Immunotherapeutic Agent > C210 - Immunoadjuvant > C2141 - Chemo Immunostimulant Adjuvant C78272 - Agent Affecting Nervous System > C47796 - Cholinergic Agonist C2140 - Adjuvant
7-Fluoro-4-methoxy-benzo[b]-thiophene-2-carboxylic acid, methyl ester
C11H9FO3S (240.02564159999997)
N-(2-chloro-6-formylpyridin-3-yl)pivalamide
C11H13ClN2O2 (240.06655080000002)
2-CHLORO-4-PIPERAZINOBENZOIC ACID
C11H13ClN2O2 (240.06655080000002)
5-[2-(trifluoromethyl)phenyl]-2-furaldehyde
C12H7F3O2 (240.03981180000002)
ethyl 2-amino-4-chloro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate
C9H9ClN4O2 (240.04140040000001)
4-chloro-N-cyclopropyl-3-nitrobenzamide
C10H9ClN2O3 (240.03016739999998)
6-chloro-7-hydroxy-4-(methoxymethyl)chromen-2-one
C11H9ClO4 (240.01893439999998)
7-Ethyl-8-mercapto-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
1-(2,2,2-Trifluoroethyl)piperazine dihydrochloride
1(2H)-Naphthalenone,3,4-dihydro-2-(2-thienylmethylene)-
1-(4-bromo-3-methylphenyl)butan-1-one
C11H13BrO (240.01497080000001)
1-PHENYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBALDEHYDE
2-Amino-4-(3-chloropropoxy)-5-methoxybenzonitrile
C11H13ClN2O2 (240.06655080000002)
7-amino-3-[(z)-prop-1-enyl]-3-cephem-4-carboxylic acid
3-(2-Chloro-2-phenylethyl)-1,3-thiazolidin-2-imine
3-chloro-4-(1,3-thiazol-4-ylmethoxy)aniline
C10H9ClN2OS (240.01240939999997)
2-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide
C10H9ClN2OS (240.01240939999997)
2,3-DIFLUORO-N-HYDROXY-6-(TRIFLUOROMETHYL)BENZIMIDAMIDE
C8H5F5N2O (240.03220199999998)
4-(THIOPHEN-2-YL)QUINAZOLINE-6-CARBALDEHYDE
C13H8N2OS (240.03573179999998)
2-AMINO-4-[(TRIFLUOROMETHYL)SULFONYL]PHENYLAMINE
C7H7F3N2O2S (240.01803180000002)
N-(2-Chloro-3-formylpyridin-4-yl)pivalamide
C11H13ClN2O2 (240.06655080000002)
Methyl (E)-3-methoxy-2-(2-chloromethylphenyl)-2-propenoate
Ethyl 2-amino-1H-indole-3-carboxylate hydrochloride
C11H13ClN2O2 (240.06655080000002)
2-CHLORO-N-{[(3,4-DIMETHYLPHENYL)AMINO]CARBONYL}ACETAMIDE
C11H13ClN2O2 (240.06655080000002)
3-acetyl-5-thiophen-2-yl-2H-1,3,4-oxadiazole-2-carboxylic acid
C9H8N2O4S (240.02047679999998)
3-Chloro-6-methyl-1-benzothiophene-2-carbohydrazide
C10H9ClN2OS (240.01240939999997)
4-(1,3-Benzothiazol-2-ylmethyl)aniline
C14H12N2S (240.07211519999998)
2-(2,4-difluorophenyl)thiazole-4-carboxamide
C10H6F2N2OS (240.01688899999996)
6-oxa-3,9-dithiabicyclo[9.3.1]pentadeca-1(15),11,13-triene
C12H16OS2 (240.06425259999997)
4-BROMO-2-(PIPERIDIN-1-YL)PYRIDINE
C10H13BrN2 (240.02620380000002)
Ethyl 6-Chloroimidazo[1,2-b]pyridazin-2-ylcarbamate
C9H9ClN4O2 (240.04140040000001)
4-(4-BROMOPHENYL)TETRAHYDRO-2H-PYRAN
C11H13BrO (240.01497080000001)
4-(3-CHLOROPHENYL)TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID
2-bromo-3-methyl-1-phenylbutan-1-one
C11H13BrO (240.01497080000001)
5-(3-trifluoromethyl-phenyl)-furan-2-carbaldehyde
C12H7F3O2 (240.03981180000002)
2-(BROMOMETHYL)-6-(PYRROLIDIN-1-YL)PYRIDINE
C10H13BrN2 (240.02620380000002)
diethyl 2-oxo-3H-pyrimidine-4,5-dicarboxylate
C10H12N2O5 (240.07461819999997)
5-Bromo-4-methyl-2-(1-pyrrolidinyl)pyridine
C10H13BrN2 (240.02620380000002)
Ethyl (2-methoxy-4-nitrophenyl)carbamate
C10H12N2O5 (240.07461819999997)
4-Thiazolemethanamine, N-methyl-2-phenyl-, hydrochloride (1:1)
N-(4-Methylphenyl)-1,3-benzothiazol-2-amine
C14H12N2S (240.07211519999998)
1-bromo-3-(cyclopropylmethoxy)-5-methylbenzene
C11H13BrO (240.01497080000001)
6-BROMO-1,4-DIMETHYL-1,2,3,4-TETRAHYDROQUINOXALINE
C10H13BrN2 (240.02620380000002)
2-[(2-ETHOXY-2-OXOETHYL)SULFANYL]BENZENECARBOXYLIC ACID
C11H12O4S (240.04562719999998)
2-(3-AMINOPROPYL)ISOINDOLINE-1,3-DIONE HYDROCHLORIDE
C11H13ClN2O2 (240.06655080000002)
2-(CHLOROMETHYL)-3,5,6,7-TETRAHYDRO-4H-CYCLOPENTA[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE
C10H9ClN2OS (240.01240939999997)
(4-CHLORO-2-(CYCLOPENTYLOXY)PHENYL)BORONIC ACID
C11H14BClO3 (240.07244740000002)
(r)-3-amino-4-(2-cyanophenyl)butanoic acid hydrochloride
C11H13ClN2O2 (240.06655080000002)
(s)-3-amino-4-(3-cyanophenyl)butanoic acid hydrochloride
C11H13ClN2O2 (240.06655080000002)
(s)-3-amino-4-(4-cyanophenyl)butanoic acid hydrochloride
C11H13ClN2O2 (240.06655080000002)
3-CHLORO-4-(THIAZOL-2-YLMETHOXY)ANILINE
C10H9ClN2OS (240.01240939999997)
ethyl 6-thiophenoimidazole-2-methoxymethyl-3-carboxylate
1,3-DIHYDRO-IMIDAZOL-2-ONE-5-(2,5-DIFLUORO) PHENYL-4-CARBOXYLIC ACID
C10H6F2N2O3 (240.03464699999998)
ethyl 3-ethoxy-2-(2,2,2-trifluoroacetyl)acrylate
C9H11F3O4 (240.06094019999998)
3-[Dichloro(methyl)silyl]propyl methacrylate
C8H14Cl2O2Si (240.01400840000002)
(r)-3-amino-4-(3-cyanophenyl)butanoic acid hydrochloride
C11H13ClN2O2 (240.06655080000002)
4-(6-Methyl-2-benzothiazolyl)benzeneamine
C14H12N2S (240.07211519999998)
5-bromo-3,3-dimethyl-2,3-dihydro-1H-inden-1-ol
C11H13BrO (240.01497080000001)
3-(4-fluorophenyl)-3-oxo-2-(4-pyridyl)propionitrile
C14H9FN2O (240.06988759999996)
Palmitoyl-Cys((RS)-2,3-di(palmitoyloxy)-propyl)-Ala-Gly-OH
C11H16N2S2 (240.07548559999998)
2-(Trifluoromethoxy)benzamidine hydrochloride
C8H8ClF3N2O (240.02772239999996)
Methyl 3-methoxy-4-(methylamino)-5-nitrobenzoate
C10H12N2O5 (240.07461819999997)
4-(5-Chloro-2-methoxy-phenyl)-thiazol-2-ylamine
C10H9ClN2OS (240.01240939999997)
2-CHLORO-6,7-DIMETHOXYQUINAZOLIN-4(3H)-ONE
C10H9ClN2O3 (240.03016739999998)
1-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde
2-Bromo-6-(piperidin-1-yl)pyridine
C10H13BrN2 (240.02620380000002)
methyl 6-chloro-4-methoxy-1H-pyrrolo[3,2-c]pyridine-2-carboxylate
C10H9ClN2O3 (240.03016739999998)
Ethyl 2-chloro-2-[2-(4-methylphenyl)hydrazono]-acetate
C11H13ClN2O2 (240.06655080000002)
4-(3-butenylsulfonyl)phenylboronic acid
C10H13BO4S (240.06275680000002)
3-bromo-2-methyl-6-pyrrolidin-1-yl-pyridine
C10H13BrN2 (240.02620380000002)
(1-(4-Bromophenyl)cyclobutyl)methanol
C11H13BrO (240.01497080000001)
3-[4-(TRIFLUOROMETHYL)PHENYL]-1H-PYRAZOLE-4-CARBALDEHYDE
1-(2-chloro-3-hydroxyphenyl)pyrrolidine-2-carboxamide
C11H13ClN2O2 (240.06655080000002)
Sulfamic acid,N-(4-methoxyphenyl)-, sodium salt (1:1)
3-carbethoxy-1,1,1-trifluorohexane-2,5-dione
C9H11F3O4 (240.06094019999998)
4-(4-CHLORO-PHENYL)-TETRAHYDRO-PYRAN-4-CARBOXYLIC ACID
5-Chloro-2,3-dihydro-2-hydroxy-1-1-oxo-1H-indene-2-carboxylate
C11H9ClO4 (240.01893439999998)
2-(6-(Trifluoromethyl)pyridin-2-yl)propan-2-amine hydrochloride
(4-((CYCLOPROPYLMETHYL)SULFONYL)PHENYL)BORONIC ACID
C10H13BO4S (240.06275680000002)
2-CHLORO-6-(NAPHTHALEN-1-YL)PYRAZINE
C14H9ClN2 (240.04542239999998)
2-CHLORO-6-(NAPHTHALEN-2-YL)PYRAZINE
C14H9ClN2 (240.04542239999998)
4-(1,3-Benzothiazol-2-yl)-2-methylaniline
C14H12N2S (240.07211519999998)
Methyl 2-[(2-methoxy-2-oxoethyl)thio]benzoate
C11H12O4S (240.04562719999998)
carbamothioic acid S-[2-(2-methoxyanilino)-2-oxoethyl] ester
1-(2-Chloro-4-pyrimidinyl)-4-piperidinecarboxamide
6-Chloro-2-methyl-3,4-dihydro-2H-1-benzopyran-2-acetic acid
1-Oxo-1H-pyrimido[1,2-a]quinoline-2-carboxylic acid
Trimethylsilyl (phenylsulfanyl)acetate
C11H16O2SSi (240.06402359999998)
Altan
A - Alimentary tract and metabolism > A06 - Drugs for constipation > A06A - Drugs for constipation > A06AB - Contact laxatives D005765 - Gastrointestinal Agents > D002400 - Cathartics D009676 - Noxae > D009153 - Mutagens Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK. Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK. Danthron is a natural product extracted from the traditional Chinese medicine Salvia miltiorrhiza Bunge. Danthron functions in regulating glucose and lipid metabolism by activating AMPK.
8-Chloro-5,7-dihydroxy-2,6-dimethylchromen-4-one
C11H9ClO4 (240.01893439999998)
3,3-Dithiobis(2-ammoniopropanoate)
C6H12N2O4S2 (240.02384719999998)
(2S)-2-azaniumyl-3-[[(2S)-2-azaniumyl-3-oxidanidyl-3-oxidanylidene-propyl]disulfanyl]propanoate
C6H12N2O4S2 (240.02384719999998)
N-(2,3-dihydroxybenzoyl)-L-serinate
The conjugate base of N-(2,3-dihydroxybenzoyl)-L-serine; major species at pH 7.3.
(1S,6R)-2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid
(2S,3R)-2-(2-aminoanilino)-3-hydroxybutanedioic acid
C10H12N2O5 (240.07461819999997)
(2R,3S)-2-hydroxy-3-[(4-hydroxyphenyl)methyl]butanedioic acid
Eucomic acid, (-)-
A natural product found particularly in Lotus japonicus and Lycoris radiata.
Balsaminolate
C12H9NaO4 (240.03985139999998)
An organic sodium salt which is the monosodium salt of 2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione. It is isolated from the aerial parts of Impatiens balsamina and acts as a selective inhibitor of cyclooxygenase 2 (COX-2) enzyme.
2-chloro-N-(3-methyl-1,3-benzothiazol-2-ylidene)acetamide
C10H9ClN2OS (240.01240939999997)
6-Methyl-2-(trifluoromethyl)-3,5-dihydroimidazo[4,5-f]benzimidazole
3-(4-Hydroxy-3,5-dimethoxyphenyl)oxirane-2-carboxylic acid
2-[(2S)-butan-2-yl]-4,6-dinitrophenol
C10H12N2O5 (240.07461819999997)
2-[(2R)-butan-2-yl]-4,6-dinitrophenol
C10H12N2O5 (240.07461819999997)
2-[(2-Chlorophenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine
2-[(4-Chlorophenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine
(Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile
C14H12N2S (240.07211519999998)
3-(6-Hydroxy-7-methoxy-1,3-benzodioxol-5-yl)propanoic acid
3-(7-Hydroxy-6-methoxy-1,3-benzodioxol-5-yl)propanoic acid
Methyl S-trimethylsilylthiosalicylate
C11H16O2SSi (240.06402359999998)
4-(Methylthio)benzoic acid, trimethylsilyl ester
C11H16O2SSi (240.06402359999998)
2-(Methylthio)benzoic acid, trimethylsilyl ester
C11H16O2SSi (240.06402359999998)
3-(Methylthio)benzoic acid, trimethylsilyl ester
C11H16O2SSi (240.06402359999998)
Methylphosphonothioate, O-isobutyl, S-trimethylsilyl
C8H21O2PSSi (240.07690960000002)
2-Normal-butylthio-5-aminothiazolo(5,4-D)pyrimidine
C9H12N4S2 (240.05033519999998)
2-(3-CARBOXYPROPIONYL)-6-hydroxy-cyclohexa-2,4-diene carboxylIC ACID
4-hydroxy-7-(1-hydroxy-2-(methylamino)ethyl)benzo[d]thiazol-2(3H)-one
D-cystine zwitterion
C6H12N2O4S2 (240.02384719999998)
A cysteine zwitterion derived from D-cysteine by transfer of a proton from each of the carboxy groups to the amino groups.
DINOSEB
C10H12N2O5 (240.07461819999997)
D010575 - Pesticides > D005659 - Fungicides, Industrial > D004140 - Dinitrophenols D010575 - Pesticides > D007306 - Insecticides D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
2-succinyl-6-hydroxycyclohexa-2,4-diene-1-carboxylic acid
cystine zwitterion
C6H12N2O4S2 (240.02384719999998)
An amino acid zwitterion that is the tautomer of cystine.
S-anthraniloyl-L-cysteine
An L-cysteine derivative obtained by formal condensation of the carboxy group of anthranilic acid with the side-chain thiol group of L-cysteine.
NCS-382 (sodium)
NCS-382 (sodium) is a potent GABA receptor antagonist. NCS-382 (sodium) has anti-sedative and anti-hypnotic activities and can be used in research related to neurological diseases[1].
7-chloro-8-hydroxy-6-methoxy-3-methylisochromen-1-one
C11H9ClO4 (240.01893439999998)
(s)-((1e)-3-[(2r)-butan-2-yldisulfanyl]prop-1-en-1-yl methanesulfinate)
2-formyl-4-hydroxy-3-(hydroxymethyl)-6-methoxy-5-methylbenzoic acid
(2s)-2-hydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid
1,8-dichloro-6-(chloromethyl)-2-methylocta-2,6-diene
9-oxo-4-xanthenecarboxylic acid
{"Ingredient_id": "HBIN014172","Ingredient_name": "9-oxo-4-xanthenecarboxylic acid","Alias": "AIDS070074; 9-ketoxanthene-4-carboxylic acid; 9-Oxoxanthene-4-carboxylic acid; AIDS-070074","Ingredient_formula": "C14H8O4","Ingredient_Smile": "C1=CC=C2C(=C1)C(=O)C3=C(O2)C(=CC=C3)C(=O)O","Ingredient_weight": "240.21 g/mol","OB_score": "25.92805863","CAS_id": "NA","SymMap_id": "SMIT07834","TCMID_id": "NA","TCMSP_id": "MOL006175","TCM_ID_id": "NA","PubChem_id": "410100","DrugBank_id": "NA"}
(2z,6e)-1,8-dichloro-3-(chloromethyl)-7-methylocta-2,6-diene
(3r,6z)-3,8-dichloro-6-(chloromethyl)-2-methylocta-1,6-diene
5-chloro-8-hydroxy-6-methoxy-3-methylisochromen-1-one
C11H9ClO4 (240.01893439999998)
methyl 6-oxo-2,5,11-trioxatricyclo[6.3.1.0⁴,¹²]dodec-9-ene-9-carboxylate
3,5-dihydroxy-4-(hydroxymethyl)-7-methoxy-6-methyl-3h-2-benzofuran-1-one
4,6,8-trihydroxy-7-methoxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
(2-acetyl-3,5-dihydroxy-4-methoxyphenyl)acetic acid
3-[5-(methoxycarbonyl)-2-oxopyran-3-yl]butanoic acid
(2s)-2-amino-3-{[(2r)-2-amino-2-carboxyethyl]disulfanyl}propanoic acid
C6H12N2O4S2 (240.02384719999998)