Exact Mass: 366.1274
Exact Mass Matches: 366.1274
Found 500 metabolites which its exact mass value is equals to given mass value 366.1274,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Glycyrol
Glycyrol is a member of the class of coumestans that is coumestan substituted by hydroxy groups at positions 1 and 9, a methoxy group at position 3 and a prenyl group at position 2 respectively. It has a role as a plant metabolite and an antineoplastic agent. It is a member of coumestans, a polyphenol, a delta-lactone and an aromatic ether. It is functionally related to a coumestan. Glycyrol is a natural product found in Glycyrrhiza, Glycyrrhiza glabra, and other organisms with data available. See also: Glycyrrhiza uralensis Root (part of). A member of the class of coumestans that is coumestan substituted by hydroxy groups at positions 1 and 9, a methoxy group at position 3 and a prenyl group at position 2 respectively. Glycyrol is found in root vegetables. Glycyrol is isolated from Glycyrrhiza sp. root (licorice Isolated from Glycyrrhiza species root (licorice). Glycyrol is found in root vegetables. Neoglycyrol is isolated from the root of Glycyrrhiza uralensis Fisch[1]. Neoglycyrol is a potential myocardial protection active compound screened from traditional patent medicine Tongmai Yangxin pill (TMYXP)[2]. Neoglycyrol is isolated from the root of Glycyrrhiza uralensis Fisch[1]. Neoglycyrol is a potential myocardial protection active compound screened from traditional patent medicine Tongmai Yangxin pill (TMYXP)[2].
Atovaquone
Atovaquone is only found in individuals that have used or taken this drug. It is a hydroxynaphthoquinone that has antimicrobial activity and is being used in antimalarial protocols. [PubChem]Atovaquone is a hydroxy- 1, 4- naphthoquinone, an analog of ubiquinone, with antipneumocystis activity. The mechanism of action against Pneumocystis carinii has not been fully elucidated. In Plasmodium species, the site of action appears to be the cytochrome bc1 complex (Complex III). Several metabolic enzymes are linked to the mitochondrial electron transport chain via ubiquinone. Inhibition of electron transport by atovaquone will result in indirect inhibition of these enzymes. The ultimate metabolic effects of such blockade may include inhibition of nucleic acid and ATP synthesis. Atovaquone also has been shown to have good in vitro activity against Toxoplasma gondii. P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01A - Agents against amoebiasis and other protozoal diseases D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent D004791 - Enzyme Inhibitors
4-[4-(Dimethylamino)phenylazo]benzoic acid N-succinimidyl ester
Semilepidinoside B
Semilepidinoside B is found in brassicas. Semilepidinoside B is an alkaloid from the seeds of Lepidium sativum (garden cress). Alkaloid from the seeds of Lepidium sativum (garden cress). Semilepidinoside B is found in garden cress and brassicas.
7-beta-D-Glucopyranosyloxybutylidenephthalide
7-beta-D-Glucopyranosyloxybutylidenephthalide is found in herbs and spices. 7-beta-D-Glucopyranosyloxybutylidenephthalide is isolated from elicitor-treated cultures of Petroselinum crispum (parsley Isolated from elicitor-treated cultures of Petroselinum crispum (parsley). 7-Hydroxybutylidenephthalide 7-glucoside is found in herbs and spices.
Curcumin II
Curcumin II is found in herbs and spices. Curcumin II is isolated from the rhizomes of Curcuma longa (turmeric). Isolated from the rhizomes of Curcuma longa (turmeric). Curcumin II is found in turmeric and herbs and spices.
Glycyrrhizaisoflavone B
Glycyrrhizaisoflavone B is found in root vegetables. Glycyrrhizaisoflavone B is a constituent of Glycyrrhiza sp. Constituent of Glycyrrhiza species Glycyrrhizaisoflavone B is found in root vegetables.
N-Caffeoyltryptophan
N-Caffeoyltryptophan is found in coffee and coffee products. N-Caffeoyltryptophan is a constituent of green coffee beans
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate
The novel carbohydrate-derived b-carboline, 1-pentahydroxypentyl-1,2,3,4-tetrahydro-b-carboline-3-carboxylic acid, was identified in fruit- and vegetable-derived products such as juices, jams, and tomato sauces. This compound occurred as two diastereoisomers, a cis isomer (the major compound) and a trans isomer, ranging from undetectable amounts to 6.5 ug/g. Grape, tomato, pineapple, and tropical juices exhibited the highest amount of this alkaloid (up to 3.8 mg/L), whereas apple, banana, and peach juices showed very low or nondetectable levels. This tetrahydro-b-carboline was also found in jams (up to 0.45 ug/g), and a relative high amount was present in tomato concentrate (6.5 ug/g) and sauce (up to 1.8 ug/g). This b-carboline occurred in fruit-derived products as a glycoconjugate from a chemical condensation of d-glucose and l-tryptophan that is highly favored at low pH values and high temperature. Production, processing treatments, and storage of fruit juices and jams can then release this b-carboline. Fruit-derived products and other foods containing this compound might be an exogenous dietary source of this glucose-derived tetrahydro-b-carboline.(PMID: 12137498).
2-Hydroxyestrone sulfate
2-Hydroxyestrone sulfate is a sulfate derivative of Estrone. Estrone (also oestrone) is an estrogenic hormone secreted by the ovary. Its molecular formula is C18H22O2. estrone has a melting point of 254.5 degrees Celsius. estrone is one of the three estrogens, which also include estriol and estradiol. estrone is the least prevalent of the three hormones, estradiol being prevalent almost always in a female body, estriol being prevalent primarily during pregnancy. estrone sulfate is relevant to health and disease due to its conversion to estrone sulfate, a long-lived derivative of estrone. estrone sulfate acts as a pool of estrone which can be converted as needed to the more active estradiol. 2-Hydroxyestrone sulfate is a sulfate derivative of Estrone
4-Hydroxyestrone sulfate
4-Hydroxyestrone sulfate is a sulfate derivative of Estrone. Estrone (also oestrone) is an estrogenic hormone secreted by the ovary. Its molecular formula is C18H22O2. estrone has a melting point of 254.5 degrees Celsius. estrone is one of the three estrogens, which also include estriol and estradiol. estrone is the least prevalent of the three hormones, estradiol being prevalent almost always in a female body, estriol being prevalent primarily during pregnancy. estrone sulfate is relevant to health and disease due to its conversion to estrone sulfate, a long-lived derivative of estrone. estrone sulfate acts as a pool of estrone which can be converted as needed to the more active estradiol.
Ridogrel
Ridogrel is only found in individuals that have used or taken this drug. It is a dual action drug useful for the prevention of systemic thrombo-embolism and as an adjunctive agent to thrombolytic therapy in acute myocardial infarction. However, there currently are no clinical indications for preferential use of ridogrel over aspirin.Ridogrel inhibits thromboxane A2 synthase and also blocks the thromboxane A2/prostaglandin endoperoxide receptors. Thromboxane synthetase produces thromboxane in platelets. Thromboxane is a vasoconstrictor and facilitates the clumping of platelets. Therefore by inhibiting the production and promotion of thromboxane, thrombolysis is enhanced. C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D005765 - Gastrointestinal Agents D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor
3'-Chloro-3'-deoxytriphasiol
3-Chloro-3-deoxytriphasiol is found in fruits. 3-Chloro-3-deoxytriphasiol is a constituent of Triphasia trifolia (limeberry). Constituent of Triphasia trifolia (limeberry). 3-Chloro-3-deoxytriphasiol is found in fruits.
C-glycosyltryptophan
Tryptophan 2-C-mannoside, also known as 2-alpha-D-mannopyranosyl-L-tryptophan or C-mannosyltryptophan, belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. Indolyl carboxylic acids and derivatives are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring. It is an L-tryptophan derivative and a C-glycosyl compound in which the hydrogen at position 2 on the indole portion has been replaced by an alpha-mannosyl residue. Tryptophan 2-C-mannoside is a very strong basic compound (based on its pKa). Tryptophan 2-C-mannoside has been identified in blood and urine and is a marker of kidney function (PMID: 29234020).
3-[4-(4-Chlorophenyl)cyclohexyl]naphthalene-1,2,4-trione
beta-Apopolygamatin
5-((4-(2-(1H-Indol-1-yl)ethoxy)phenyl)methyl)-2,4-thiazolidinedione
Ilaprazole
C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent > C29723 - Proton Pump Inhibitor
5-[[Pyridin-3-yl-[3-(trifluoromethyl)phenyl]methylidene]amino]oxypentanoic acid
7,7,8,8-Tetrakis(methoxydiazenyl)bicyclo[4.2.0]octa-1(6),3-diene-2,5-dione
2-(beta-D-Mannopyranosyl)-L-tryptophan
Camptothecin sodium
Xanthoangelol C
Xanthoangelol c is a member of the class of compounds known as 3-prenylated chalcones. 3-prenylated chalcones are chalcones featuring a C5-isoprenoid unit at the 3-position. Thus, xanthoangelol c is considered to be a flavonoid lipid molecule. Xanthoangelol c is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Xanthoangelol c can be found in angelica, which makes xanthoangelol c a potential biomarker for the consumption of this food product.
Vellokaempferol 3-methyl ether
5-[[3-(4,5-Dihydro-5,5-dimethyl-4-oxo-2-furanyl)-2-butenyl]oxy]-7H-furo[3,2-g][1]benzopyran-7-one
5-Hydroxy-8-(4-hydroxy-3-methoxyphenyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b]dipyran-6-one
5,7-Dihydroxy-2-isopropylchromone-8-beta-D-glucoside
3-Hydroxyalpinumisoflavone 4-methyl ether
Glyflavanone A
An extended flavonoid that is 2,3-dihydro-4H,8H-pyrano[2,3-f]chromen-4-one which is substituted by a p-methoxyphenyl group at the 2-pro-S position, a methoxy group at position 5, and two methyl groups at position 8.
6,6-Dimethylpyrano[2,3:6,5]-2-hydroxy-4,4-dimethoxychalcone
Isoglycyrol
Praecansone B
cis-Tephrostachin
Glycyrol
Neoglycyrol is isolated from the root of Glycyrrhiza uralensis Fisch[1]. Neoglycyrol is a potential myocardial protection active compound screened from traditional patent medicine Tongmai Yangxin pill (TMYXP)[2]. Neoglycyrol is isolated from the root of Glycyrrhiza uralensis Fisch[1]. Neoglycyrol is a potential myocardial protection active compound screened from traditional patent medicine Tongmai Yangxin pill (TMYXP)[2].
UK-416244
CONFIDENCE standard compound; INTERNAL_ID 1059; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7222; ORIGINAL_PRECURSOR_SCAN_NO 7220 CONFIDENCE standard compound; INTERNAL_ID 1059; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7214; ORIGINAL_PRECURSOR_SCAN_NO 7212 CONFIDENCE standard compound; INTERNAL_ID 1059; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7232; ORIGINAL_PRECURSOR_SCAN_NO 7230 CONFIDENCE standard compound; INTERNAL_ID 1059; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7248; ORIGINAL_PRECURSOR_SCAN_NO 7246 CONFIDENCE standard compound; INTERNAL_ID 1059; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7266; ORIGINAL_PRECURSOR_SCAN_NO 7262 CONFIDENCE standard compound; INTERNAL_ID 1059; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7269; ORIGINAL_PRECURSOR_SCAN_NO 7264
2-{2-[5-(ethoxycarbonyl)-2-morpholinoanilino]-2-oxoethoxy}acetic acid
2-(3,4-Dimethoxyphenyl)-8,8-dimethyl-2,3-dihydro-4H,8H-benzo[1,2-b:3,4-b]dipyran-4-one
(1alpha,2alpha,3beta,4beta,6beta,8alpha,9alpha)-1,2,3,4,6,8,9,13,14-Nonahydroxydihydro-beta-agarofuran|Euonyminol|Euonyminol?
1-(5-hydroxy-7-methoxy-2,2-dimethyl-2H-chromen-6-yl)-3-(4-methoxyphenyl)propenone|2-methoxy-4,6-dihydroxylonchocarpin|glychalcone A|glychalcone-A
6-deoxy-4-O-[(2E)-3-(4-methoxyphenyl)-1-oxoprop-2-en-1-yl]-alpha-L-mannopyranose 3-acetate|asiatiside A
3-(3,4-dihydro-4-oxoquinazolin-2-yl)propyl beta-D-glucopyranoside|pegamine beta-D-glucopyranoside
2-alpha-D-C-mannopyranosyl-L-tryptophan|2-alpha-D-mannopyranosyl-L-tryptophan|alpha-C-Mannosyltryptophan|C2-alpha-D-mannosylpyranosyl-L-tryptophan|C2-alpha-D-mannosylpyranosyltryptophan
2-hydroxy-4,4-dimethoxy-5,6-(2,2-dimethylpyrano)chalcone
2,2-Dimethyl-5-hydroxy-8-(3-hydroxy-4-methoxyphenyl)-6,7,8,9-tetrahydro-2H-naphtho[2,3-b]pyran-6-one
methyl [11-hydroxy-2-(2-oxopropylidene)-5,6-dihydro-2H-1,4-dioxabenzo[de]anthracen-5-yl]acetate
3-butenyl 6-O-(alpha-L-arabinopyranosyl)-beta-D-glucopyranoside
(+)-(7S,8S)-1,4-dihydroxy-3,3,5-trimethoxy-7,8,9-trinor-8,4-oxyneolignan-7,9-diol
A lignan that consists of propane-1,3-diol substituted by a 4-hydroxy-3-methoxyphenyl substituent at position 1 and a 4-hydroxy-2,6-dimethoxyphenoxy substituent at position 2. It has been isolated from the stems of Sinocalamus affinis.
N-[2-(5-hydroxy-1H-indol-3-yl)-2-oxoethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
2-(2,4-Dihydroxyphenyl)-5-hydroxy-6-methyl-8,8-dimethyl-8H-benzo[1,2-b:3,4-b]dipyran-4-one
2-(4-methylpentanoyl)-1-hydroxy-8-methoxy-3-methylanthracene-9,10-dione|fistulaquinone A
2-methoxyl-7,6-dihydroxy-(6,6-dimethylpyrano)-(4,3:2,3)isoflavone|hirtellanine I
8,9-dihydroxy-1-methoxy-[6,6-dimethylpyrano(2,3:2,3)]pterocarpene|hirtellanine D
2,5-dimethoxy-3,6-di(p-methoxyphenyl)phenol|2?-hydroxy-4,6?,3?,4-tetramethoxy-p-terphenyl|4,3,6,4-Tetramethoxy-5-hydroxy-p-terphenyl
5-hydroxy-2-(1-hydroxy-1-methylethyl)-3-methoxyfurane-(2,3:7,8)-flavone
((E)-3-Methoxy-5-oxo-4-phenyl-5H-[2]furyliden)-(2-methoxy-phenyl)-essigsaeure-methylester|((E)-3-methoxy-5-oxo-4-phenyl-5H-[2]furylidene)-(2-methoxy-phenyl)-acetic acid methyl ester|(E)-O-methyl leprapinic acid|(E)-O-methylleprapinic acid|leprapinic acid methyl ether|Methyl leprapinate
3-hydroxy-8,9-methylenedioxy-2,2-dimethyl-pyrano-(5,6:1,2)[6aR,11aR]pterocarpan|maackiapterocarpan B
3-O-acetyl-2-O-p-methoxycinnamoyl-alpha-L-rhamnopyranose|ningposide D
(E)-3-(3,4-dimethoxyphenyl)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)prop-2-en-1-one|3,4-dimethoxy-2-hydroxy-6,6-dimethylchromeno-[2,3:4,3]-chalcone
(RS)-Plectranthon B ( = (RS)-<2-(3-Hydroxy-5,7,8-trimethyl-1,4-dioxophenanthren-2-yl)-1-methylethyl>-acetat)|(RS)-Plectranthon B { = (RS)-[2-(3-Hydroxy-5,7,8-trimethyl-1,4-dioxophenanthren-2-yl)-1-methylethyl]-acetat}|plectranthon B|Plectranthone B
6-deoxy-4-O-[(2E)-3-(4-methoxyphenyl)-1-oxoprop-2-en-1-yl]-alpha-L-mannopyranose 2-acetate|asiatiside D
Benzoic acid 1-methyl-1-(2,3-dihydro-9-hydroxy-7-oxo-7H-furo[3,2-g][1]benzopyran-2-yl)ethyl ester
Candidusin C
A member of the class of dibenzofurans that is dibenzo[b,d]furan substituted by methoxy groups at positions 6 and 9, hydroxy groups at positions 2 and 3 and a 4-methoxyphenyl group at position 7. It has been isolated from Aspergillus taichungensis.
(3R)-5-hydroxy-6,7-(2,2-dimethylchromene)-3-(4-methoxybenzyl)-4-chromanone|ledebourin A
9-hydroxy-3,4-dimethoxy-3,4-methylenedioxy-9-oxo-Delta7,8,7,8-6.7,8.8-neolignan
(+/-)-5-methoxy-2-(4-methoxyphenyl)-8,8-dimethyl-2,3-dihydro-8H-pyrano[2,3-f]chromen-4-one|(+/-)-glyflavanone-A
Di-O-methyldemethoxycurcumin
Di-O-methyldemethoxycurcumin, a curcuminoid analog, inhibits IL-6 production with an EC50 of 16.20 μg/mL. Anti-inflammatory and antioxidant properties[1].
ATOVAQUONE
P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01A - Agents against amoebiasis and other protozoal diseases D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent D004791 - Enzyme Inhibitors
C21H18O6_7-Oxabicyclo[4.1.0]hept-4-ene-2,3-diol, 1-[(benzoyloxy)methyl]-, 3-benzoate
Ala Ala Cys Cys
Ala Cys Ala Cys
Ala Cys Cys Ala
Ala Cys Ser Ser
Ala Ser Cys Ser
Ala Ser Ser Cys
Cys Ala Ala Cys
Cys Ala Cys Ala
Cys Ala Ser Ser
Cys Cys Ala Ala
Cys Gly Gly Met
Cys Gly Met Gly
Cys Gly Ser Thr
Cys Gly Thr Ser
Cys Met Gly Gly
Cys Ser Ala Ser
Cys Ser Gly Thr
Cys Ser Ser Ala
Cys Ser Thr Gly
Cys Thr Gly Ser
Cys Thr Ser Gly
Gly Cys Gly Met
Gly Cys Met Gly
Gly Cys Ser Thr
Gly Cys Thr Ser
Gly Gly Ala Tyr
Gly Gly Cys Met
Gly Gly Met Cys
Gly Met Cys Gly
Gly Met Gly Cys
Gly Ser Cys Thr
Gly Ser Thr Cys
Gly Thr Cys Ser
Gly Thr Ser Cys
Met Cys Gly Gly
Met Gly Cys Gly
Met Gly Gly Cys
Ser Ala Cys Ser
Ser Ala Ser Cys
Ser Cys Ala Ser
Ser Cys Gly Thr
Ser Cys Ser Ala
Ser Cys Thr Gly
Ser Gly Cys Thr
Ser Gly Thr Cys
Ser Ser Ala Cys
Ser Ser Cys Ala
Ser Ser Ser Ser
Ser Thr Cys Gly
Ser Thr Gly Cys
Thr Cys Gly Ser
Thr Cys Ser Gly
Thr Gly Cys Ser
Thr Gly Ser Cys
Thr Ser Cys Gly
Thr Ser Gly Cys
Ridogrel
C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D005765 - Gastrointestinal Agents D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor
Tetrahydropentoxyline
A member of the class of beta-carbolines that is 2,3,4,9-tetrahydro-1H-beta-carboline in which a hydrogen at positions 1 and 3 have been replaced by a (5S)-D-arabinityl and carboxy groups, respectively. It is a metabolite found in human urine.
Semilepidinoside B
7-b-D-Glucopyranosyloxybutylidenephthalide
Glycyrrhizaisoflavone B
3''-Chloro-3''-deoxytriphasiol
[3-(Benzoyloxy)-2-hydroxy-7-oxabicyclo[4.1.0]hept-4-en-1-yl]methyl benzoate
3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl 2-(prop-1-en-2-yl)-2,3-dihydrobenzofuran-5-carboxylate
ST 18:4;O3;S
(5-nitro-1-benzothiophen-2-yl)-(4-phenylpiperidin-1-yl)methanone
1-(4-Methoxybenzyl)-6-((trimethylsilyl)ethynyl)-1H-pyrido[2,3-b][1,4]oxazin-2(3H)-one
1-(1,4-DIHYDROXY-3-PHENYLNAPHTHALEN-2-YL)-3-PHENYLPROP-2-EN-1-ONE
methyl 2-[1-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzoate
2,6-DICHLORO-4,8-DIPIPERIDINOPYRIMIDINO[5,4-D]PYRIMIDINE
3-[(2,4-dihydro-2,4-dimethyl-3H-1,2,4-triazol-3-ylidene)hydrazono]-1-methyl-2-phenyl-3H-indolium chloride
(1S,2S)-(+)-N-(4-Toluenesulfonyl)-1,2-Diphenylethylenediamine
3-chloromethyl-2,6-dimethyl-4-[3-(methylsulfonyl)propoxy]biphenyl
N-((1R,2R)-2-Amino-1,2-diphenylethyl)-4-methylbenzenesulfonamide
methyl 4-chloro-1-[tris(propan-2-yl)silyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
3-(5,5-dioxophenothiazin-10-yl)-N,N,2-trimethylpropan-1-amine,hydrochloride
7-Amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid diphenylmethyl ester
4-(4-fluoro-3-(piperazine-1-carbonyl)benzyl)phthalazin-1(2H)-one
3-(3-BIPHENYL-4-YL-1-PHENYL-1H-PYRAZOL-4-YL)-ACRYLIC ACID
(2E)-2-(5,6-Dimethoxy-2,3-dihydro-1H-inden-1-ylidene)-5,6-dimethoxy-1-indanone
(1R,5R,7S,8S)-7-(Acetyloxy)-8-(phenylmethoxy)-3,6-dioxabicyclo[3.2.1]octane-5-methanol 5-acetate
(3aR,4S,6R,6aS)-6-[7-Amino-5-(propylthio)-3H-1,2,3-triazolo[4,5-d]pyrimidin-3-yl]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-ol
3,4:5,6-Di-O-isopropylidene-D-glucose diethyl mercaptal
ETHYL 7-((4-CHLORO-7-METHOXYQUINAZOLIN-6-YL)OXY)HEPTANOATE
Rovatirelin
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C76367 - Thyrotropin-Releasing Hormone Analogue D000890 - Anti-Infective Agents > D023303 - Oxazolidinones
Abacavir 5-phosphate
D009676 - Noxae > D000963 - Antimetabolites > D015224 - Dideoxynucleosides
1-(Phenethylamino)-3H-naphtho[1,2,3-de]quinoline-2,7-dione
BRD7389 is a specific RSK family kinase inhibitor with IC50s of 1.5 μM, 2.4 μM, and 1.2 μM for RSK1, RSK2, and RSK3, respectively. BRD7389 is a small-molecule inducer of insulin expression in pancreatic α-cells[1].
3-[2-(1,3-Benzothiazol-2-yl)hydrazinyl]-1-(4-ethylphenyl)pyrrolidine-2,5-dione
N-[2-(4-methylphenoxy)-1-oxoethyl]-2-(5-phenyl-2-tetrazolyl)acetohydrazide
4-(6-Methyl-4-phenyl-2-quinazolinyl)-1,3-dihydroquinoxalin-2-one
1alpha,5alpha-Epidithio-17a-oxa-D-homoandrostan-3,17-dione
3-((Dimethylamino)methyl)-4-(3-methyl-4-(methylthio)phenoxy)benzenesulfonamide
2-[4-(4-Chlorophenyl)cyclohexylidene]-3,4-dihydroxy-1(2H)-naphthalenone
(4-Benzoyloxy-5-hydroxy-7-oxabicyclo[4.1.0]hept-2-en-6-yl)methyl benzoate
(2,5-Dimethylbenzene-1,4-Diyl)dimethanediyl Bis(N-Carbamimidoylcarbamimidothioate)
(4S)-2-[(S)-[(2R)-2-amino-2-phenylacetamido](carboxylato)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylate
5-[[Pyridin-3-yl-[3-(trifluoromethyl)phenyl]methylidene]amino]oxypentanoic acid
7,7,8,8-Tetrakis(methoxydiazenyl)bicyclo[4.2.0]octa-1(6),3-diene-2,5-dione
(1R)-1,5-anhydro-1-{3-[(2S)-2-azaniumyl-2-carboxylatoethyl]-1H-indol-2-yl}-D-mannitol
1-[[3-(9-Carbazolyl)-1-oxopropyl]amino]-3-(2-methylprop-2-enyl)thiourea
tryptophan N-glucoside
A L-tryptophan derivative that is L-tryptophan in which the hydrogen attached to the indole nitrogen replaced by a beta-D-glucosyl residue.
1-(2-Furanylmethyl)-7,7-dimethyl-2-(4-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione
3-[2-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-1-methyl-2-indolecarboxylic acid
2-Methoxy-4-[(8-methoxy-4,5-dihydro-naphtho[1,2-d]thiazol-2-ylimino)-methyl]-phenol
N-(2,6-dimethylphenyl)-2-[(6-methoxy-2-methyl-4-quinolinyl)thio]acetamide
(E)-N-(2-methoxyethyl)-3-phenyl-N-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)prop-2-enamide
N-(4-((1,1-Biphenyl)-4-ylamino)quinazolin-6-yl)acrylamide
(3,4-Dimethoxyphenyl)-[4-[(2-hydroxy-5-methylphenyl)-oxomethyl]-1-pyrazolyl]methanone
1-Butyl-3-[[2-oxo-1-(phenylmethyl)-3-indolylidene]amino]thiourea
N-[2-[(3-cyano-8-methyl-2-quinolinyl)amino]ethyl]benzenesulfonamide
13-(pyridin-3-ylmethyl)-11,15-dihydro-9H-9,10-[3,4]epipyrroloanthracene-12,14(10H,13H)-dione
N-[(E)-(4-Methylphenyl)methylideneamino]-2-pyridin-3-ylquinoline-4-carboxamide
Ethyl 2-[5-hydroxy-4-(trifluoromethyl)biphenyl-3-yl]pentanoate
6-{[5-(p-Nitrophenoxy)-5-oxopentanoyl]amino}hexanoic acid
(2S)-4-(1H-indol-3-yl)-2-({[(3S,4S,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl}amino)butanoic acid
[2-Propanoyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropyl] propanoate
[1-Acetyloxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] butanoate
Ilaprazole
C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent > C29723 - Proton Pump Inhibitor
2-alpha-mannosyl-L-tryptophan
A C-glycosyl compound that is L-tryptophan in which the hydrogen at position 2 on the indole protion has been replaced by an alpha-mannosyl residue.
3-[4-(4-Chlorophenyl)cyclohexyl]naphthalene-1,2,4-trione
1-(1,2,3,4,5-Pentahydroxypent-1-yl)-1,2,3,4-tetrahydro-beta-carboline-3-carboxylate
abacavir monophosphate
The organic phosphate that is the 5-monophosphate of abacavir.
beta-D-galactosyl-(1->3)-N-acetyl-D-galactosaminyl group
2-alpha-mannosyl-L-tryptophan zwitterion
An L-alpha-amino acid zwitterion that is 2-alpha-mannosyl-L-tryptophan in which a proton has been transferred from the carboxy group to the amino group. It is the major species at pH 7.3.
ML327
ML327 is a blocker of MYC which can also de-repress E-cadherin transcription and reverse Epithelial-to-Mesenchymal Transition (EMT).
ST-1006
ST-1006 is a potent histamine H4 receptor agonist with a pKi value of 7.94. ST-1006 has anti-inflammatory effect[1][2].
methyl 3-(4-{[4-(buta-2,3-dien-1-yloxy)phenyl]methoxy}-3-methoxyphenyl)prop-2-enoate
2-(3,4-dimethoxyphenyl)-8,8-dimethyl-2h,3h-pyrano[2,3-f]chromen-4-one
methyl (2r)-3-[(1r)-6-ethyl-1,5-dihydroxy-2,7-dimethoxy-4-oxonaphthalen-1-yl]-2-hydroxypropanoate
4,8-dihydroxy-7-methoxy-6-(3-methylbut-2-en-1-yl)furo[3,2-b]xanthen-5-one
5',7-dihydroxy-5-methoxy-2',2'-dimethyl-[3,6'-bichromen]-2-one
2-{7,11,17,19,23-pentaoxahexacyclo[11.10.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁶,²⁰]tricosa-2(10),3,8,14,16(20),21-hexaen-6-yl}prop-2-en-1-ol
(8r)-5-hydroxy-8-(3-hydroxy-4-methoxyphenyl)-2,2-dimethyl-7h,8h,9h-cyclohexa[g]chromen-6-one
(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[4-(1h-imidazol-2-ylmethyl)-2-methoxyphenoxy]oxane-3,4,5-triol
methyl (2r,4r)-4-(5-hydroxy-7-methoxy-2-methyl-4-oxochromen-8-yl)-2,4-dimethoxybutanoate
3-methyl-5-[2-methyl-4-({7-oxofuro[3,2-g]chromen-4-yl}oxy)but-2-en-1-yl]-5h-furan-2-one
(3as,4r,6ar)-6a-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-3a-(dimethoxymethyl)-4-hydroxy-tetrahydrocyclopenta[c]furan-1-one
8-methoxy-3-(4-methoxyphenyl)-7-[(3-methylbut-2-en-1-yl)oxy]chromen-4-one
1-(5,7-dimethoxy-2,2-dimethylchromen-6-yl)-3-hydroxy-3-phenylprop-2-en-1-one
2,2-dimethyl-5-[(2e)-4-({7-oxofuro[3,2-g]chromen-4-yl}oxy)but-2-en-2-yl]furan-3-one
5-hydroxy-8-(3-hydroxy-4-methoxyphenyl)-2,2-dimethyl-7h,8h,9h-cyclohexa[g]chromen-6-one
3-(acetyloxy)-2,5-dihydroxy-6-methyloxan-4-yl 3-(4-methoxyphenyl)prop-2-enoate
(2s,3r,4s,5s,6r)-2-[(2-hydroxy-3-methoxy-8-methylnaphthalen-1-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
3-butenyl-6'-o-α-l-arabinopyranosyl-β-d-gluco-pyranoside
{"Ingredient_id": "HBIN008350","Ingredient_name": "3-butenyl-6'-o-\u03b1-l-arabinopyranosyl-\u03b2-d-gluco-pyranoside","Alias": "NA","Ingredient_formula": "C15H26O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2781","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anticancer flavonoid pmv70p691-107
{"Ingredient_id": "HBIN016335","Ingredient_name": "anticancer flavonoid pmv70p691-107","Alias": "NA","Ingredient_formula": "C22H22O5","Ingredient_Smile": "CC1(C=CC2=C(C(=C(C=C2O1)OC)C(=O)CC(=O)C3=CC=CC=C3)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1410","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
