Exact Mass: 340.1136
Exact Mass Matches: 340.1136
Found 500 metabolites which its exact mass value is equals to given mass value 340.1136,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
8-Prenylnaringenin
Sophoraflavanone B is a trihydroxyflavanone that is (S)-naringenin having a prenyl group at position 8. It has a role as a platelet aggregation inhibitor and a plant metabolite. It is a trihydroxyflavanone, a member of 4-hydroxyflavanones and a (2S)-flavan-4-one. It is functionally related to a (S)-naringenin. It is a conjugate acid of a sophoraflavanone B(1-). 8-Prenylnaringenin is a natural product found in Macaranga conifera, Macaranga denticulata, and other organisms with data available. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens A trihydroxyflavanone that is (S)-naringenin having a prenyl group at position 8. INTERNAL_ID 2299; CONFIDENCE Reference Standard (Level 1) CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2299
(S)-4',5,7-Trihydroxy-6-prenylflavanone
6-prenylnaringenin is a trihydroxyflavanone having a structure of naringenin prenylated at C-6. It has a role as a T-type calcium channel blocker. It is a trihydroxyflavanone, a member of 4-hydroxyflavanones and a (2S)-flavan-4-one. It is functionally related to a (S)-naringenin. 6-Prenylnaringenin is a natural product found in Macaranga denticulata, Wyethia angustifolia, and other organisms with data available. (S)-4,5,7-Trihydroxy-6-prenylflavanone is found in alcoholic beverages. (S)-4,5,7-Trihydroxy-6-prenylflavanone is isolated from Humulus lupulus (hops). Isolated from Humulus lupulus (hops). 6-Prenylnaringenin is found in beer and alcoholic beverages. (2S)-6-Prenylnaringenin is the most efficient compound in forebrain. (2S)-6-Prenylnaringenin acts as a GABAA positive allosteric modulator at α+β- binding interface[1]. (2S)-6-Prenylnaringenin is the most efficient compound in forebrain. (2S)-6-Prenylnaringenin acts as a GABAA positive allosteric modulator at α+β- binding interface[1]. (2S)-6-Prenylnaringenin is the most efficient compound in forebrain. (2S)-6-Prenylnaringenin acts as a GABAA positive allosteric modulator at α+β- binding interface[1].
Diphacinone
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
Desmethylxanthohumol
Desmethylxanthohumol is a member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 4, 2, 4, and 6 and a 3-methylbut-2-en-1-yl group at position 3. It has a role as a plant metabolite. It is a member of chalcones and a 2-acyl-4-prenylphloroglucinol. It is functionally related to a trans-chalcone. It is a conjugate acid of a desmethylxanthohumol(1-). Desmethylxanthohumol is a natural product found in Helichrysum dregeanum, Humulus lupulus, and other organisms with data available. A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 4, 2, 4, and 6 and a 3-methylbut-2-en-1-yl group at position 3. Desmethylxanthohumol is found in alcoholic beverages. Desmethylxanthohumol is a constituent of Humulus lupulus (hops) D006133 - Growth Substances > D043924 - Angiogenesis Modulating Agents D000970 - Antineoplastic Agents > D020533 - Angiogenesis Inhibitors D006133 - Growth Substances > D006131 - Growth Inhibitors
5-Deoxykievitone
Isolated from pods of Phaseolus vulgaris (kidney bean) and Phaseolus mungo (mung bean). 5-Deoxykievitone is found in many foods, some of which are common bean, green bean, mung bean, and gram bean. 5-Deoxykievitone is found in common bean. 5-Deoxykievitone is isolated from pods of Phaseolus vulgaris (kidney bean) and Phaseolus mungo (mung bean).
3'-Ketolactose
3-Ketolactose is a metabolite in galactose metabolism (KEGG). [HMDB]. 3-Ketolactose is found in many foods, some of which are lentils, fireweed, cardamom, and elliotts blueberry. 3-Ketolactose is a metabolite in galactose metabolism (KEGG).
Glepidotin B
A trihydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 3, 5 and 7 and a prenyl group at position 8 respectively.
Glyceollidin II
Phytoalexin from Glycine max (soybean). Glyceollidin II is found in soy bean, fats and oils, and pulses. Glyceollidin II is found in fats and oils. Phytoalexin from Glycine max (soybean).
(S)-4',5,7-Trihydroxy-3'-prenylflavanone
(S)-4,5,7-Trihydroxy-3-prenylflavanone is found in herbs and spices. (S)-4,5,7-Trihydroxy-3-prenylflavanone is a constituent of Glycyrrhiza glabra (licorice)
Licocoumarone
Licocoumarone is found in herbs and spices. Licocoumarone is isolated from roots of Glycyrrhiza uralensis (Chinese licorice). Isolated from roots of Glycyrrhiza uralensis (Chinese licorice). Licocoumarone is found in herbs and spices.
Glyceollidin I
Phytoalexin from Glycine max (soybean). Glyceollidin I is found in soy bean and pulses. Glyceollidin I is found in pulses. Phytoalexin from Glycine max (soybean).
3,4,5-trihydroxy-6-[(2,3,5-trihydroxy-6-methyloxan-4-yl)oxy]oxane-2-carboxylic acid
Morachalcone A
Morachalcone A is found in breadfruit. Morachalcone A is a constituent of Morus alba (white mulberry). Constituent of Morus alba (white mulberry). Morachalcone A is found in breadfruit and fruits.
Dolichin B
Dolichin A is found in cowpea. Dolichin A is isolated from bacteria-inoculated leaves of Dolichos biflorus (papadi Isolated from bacteria-inoculated leaves of Dolichos biflorus (papadi). Dolichin A is found in fruits and cowpea.
Selinone
Isolated from roots of Angelica archangelica (angelica). 4-Prenylnaringenin is found in fats and oils, herbs and spices, and green vegetables. Selinone is found in fats and oils. Selinone is isolated from roots of Angelica archangelica (angelica).
Oenanthoside A
Oenanthoside A is found in herbs and spices. Oenanthoside A is a constituent of Oenanthe javanica (water dropwort) Constituent of Oenanthe javanica (water dropwort). Oenanthoside A is found in herbs and spices.
4-O-beta-D-Glucopyranuronosyl-L-fucose
4-O-beta-D-Glucopyranuronosyl-L-fucose is isolated from the partial acid hydrolysate of tragacanthic acid, the major polysaccharide component of tragacanth gum. Isolated from the partial acid hydrolysate of tragacanthic acid, the major polysaccharide component of tragacanth gum
Linocinnamarin
Linocinnamarin is found in coffee and coffee products. Linocinnamarin is a glycoside from seeds of Linum usitatissimum (flax
2-O-a-D-Galactopyranuronosyl-L-rhamnose
2-O-a-D-Galactopyranuronosyl-L-rhamnose is found in coffee and coffee products. 2-O-a-D-Galactopyranuronosyl-L-rhamnose is isolated from partial acid hydrolysates of Linum usitatissimum (flax), Plantago seed, Hibiscus esculentus (okra). Isolated from partial acid hydrolysates of Linum usitatissimum (flax), Plantago seed, Hibiscus esculentus (okra). 2-O-a-D-Galactopyranuronosyl-L-rhamnose is found in coffee and coffee products, fats and oils, and fruits.
15-[(3,3-dimethyloxiran-2-yl)methyl]-8,17-dioxatetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadeca-2(7),3,5,11(16),12,14-hexaene-5,14-diol
2-O-(4-O-Methyl-a-D-glucopyranuronosyl)-D-xylose
2-O-(4-O-Methyl-a-D-glucopyranuronosyl)-D-xylose is found in cereals and cereal products. 2-O-(4-O-Methyl-a-D-glucopyranuronosyl)-D-xylose is an important aldobiouronic acid that occurs as a structural unit of polysaccharides. 2-O-(4-O-Methyl-a-D-glucopyranuronosyl)-D-xylose is widely distributed in plant
4-O-(4-O-Methyl-alpha-D-glucopyranuronosyl)-L-arabinose
4-O-(4-O-Methyl-alpha-D-glucopyranuronosyl)-L-arabinose is found in citrus. 4-O-(4-O-Methyl-alpha-D-glucopyranuronosyl)-L-arabinose is isolated from the partial hydrolysates of lemon gum. Isolated from the partial hydrolysates of lemon gum. 4-O-(4-O-Methyl-alpha-D-glucopyranuronosyl)-L-arabinose is found in citrus and fruits.
3-O-(4-O-Methyl-a-D-glucopyranuronosyl)-L-arabinose
3-O-(4-O-Methyl-a-D-glucopyranuronosyl)-L-arabinose is found in fruits. 3-O-(4-O-Methyl-a-D-glucopyranuronosyl)-L-arabinose is isolated from the autohydrolysate of golden apple (Spondias cytherea) gum. Isolated from the autohydrolysate of golden apple (Spondias cytherea) gum. 3-O-(4-O-Methyl-a-D-glucopyranuronosyl)-L-arabinose is found in fruits.
1-Hydroxy-3,5-dimethoxy-2-prenylxanthone
1-Hydroxy-3,5-dimethoxy-2-prenylxanthone is found in fruits. 1-Hydroxy-3,5-dimethoxy-2-prenylxanthone is a constituent of Garcinia mangostana (mangosteen). Constituent of Garcinia mangostana (mangosteen). 1-Hydroxy-3,5-dimethoxy-2-prenylxanthone is found in fruits.
trans-isoeugenol-O-glucuronide
trans-isoeugenol-O-glucuronide is a conjugate of trans-isoeugenol and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. Glucuronidation, the conversion of chemical compounds to glucuronides, is a method that animals use to assist in the excretion of toxic substances, drugs or other substances that cannot be used as an energy source. Glucuronic acid is attached via a glycosidic bond to the substance, and the resulting glucuronide, which has a much higher water solubility than the original substance, is eventually excreted by the kidneys. Enzymes that cleave the glycosidic bond of a glucuronide are called glucuronidases. (Wikipedia)
(2S,3S,3Ar)-2-(2H-1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-3a-(prop-2-en-1-yl)-3,3a-dihydro-1-benzofuran-6(2H)-one
8-Prenylnaringenin
(s)-4,5,7-trihydroxy-8-prenylflavanone is a member of the class of compounds known as 8-prenylated flavanones. 8-prenylated flavanones are flavanones that features a C5-isoprenoid substituent at the 8-position. Thus, (s)-4,5,7-trihydroxy-8-prenylflavanone is considered to be a flavonoid lipid molecule (s)-4,5,7-trihydroxy-8-prenylflavanone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (s)-4,5,7-trihydroxy-8-prenylflavanone can be found in beer, which makes (s)-4,5,7-trihydroxy-8-prenylflavanone a potential biomarker for the consumption of this food product.
Ethyl 3-(o-chlorophenyl)-5-methyl-1-phenyl-1h-pyrazole-4-carboxylate
N-(6-Aminohexyl)-5-chloro-1-naphthalenesulfonamide
D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D004791 - Enzyme Inhibitors
(+)-Dihydrowighteone
(+)-dihydrowighteone is a member of the class of compounds known as isoflavanones. Isoflavanones are polycyclic compounds containing an isoflavan skeleton which bears a ketone at position C4. Thus, (+)-dihydrowighteone is considered to be a flavonoid lipid molecule (+)-dihydrowighteone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (+)-dihydrowighteone can be found in adzuki bean, which makes (+)-dihydrowighteone a potential biomarker for the consumption of this food product.
Burchellin
A neolignan with formula C20H20O5 that is isolated from Ocotea cymbarum and Piper wallichii. It is active against a variety of parasites including T. cruzi, the vector for Chagas disease.
5,4,-Dihydroxy-4,4-Dimethyl-5-[2,3:7,6]methyldihydrofuranoflavanone
3,4-Dihydro-4,5,10-trimethyl-4-vinylspiro[3,6-dioxabicyclo[3.1.0]hexane-2,2-[2H,5H]pyrano[3,2-c][1]benzopyran]-5-one
3,4-(3-Hydroxy-2,2-dimethyldihydropyrano)-4,2-dihydroxychalcone
5,7-Dihydroxy-8-C-(4-hydroxy-3-methyl-2-butenyl)flavanone
euchrenone-a7
A trihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 7, 2 and 4 and a prenyl group at position 8.
Methyl 6-O-p-trans-coumaroyl-beta-D-glucopyranoside
CP-863187
CONFIDENCE standard compound; INTERNAL_ID 478; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8284; ORIGINAL_PRECURSOR_SCAN_NO 8283 CONFIDENCE standard compound; INTERNAL_ID 478; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8325; ORIGINAL_PRECURSOR_SCAN_NO 8323 CONFIDENCE standard compound; INTERNAL_ID 478; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8328; ORIGINAL_PRECURSOR_SCAN_NO 8326 CONFIDENCE standard compound; INTERNAL_ID 478; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8370; ORIGINAL_PRECURSOR_SCAN_NO 8368 CONFIDENCE standard compound; INTERNAL_ID 478; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8368; ORIGINAL_PRECURSOR_SCAN_NO 8366 CONFIDENCE standard compound; INTERNAL_ID 478; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8380; ORIGINAL_PRECURSOR_SCAN_NO 8379
4-(3-glucopyranosyloxy-4-hydroxyphenyl)-3-buten-2-one|4-(3-glucopyranosyloxy-4-hydroxyphenyl)-(E)-3-buten-2-one
6,7-dimethyl-1-ribitol-1-yl-1,4-dihydroquinoxaline-2,3-dione
2-O-(4-O-methyl-alpha-D-glucopyranosyluronic acid)-D-xylose|O4-methyl-O1-D-xylose-2-yl-alpha-D-glucopyranuronic acid|O4-Methyl-O1-D-xylose-2-yl-alpha-D-glucopyranuronsaeure
1,9-didesmerhylgaruganin III|1,9-didesmethylgaruganin III
4alpha-hydroxy-3beta-chloro-8alpha-acetoxyguai-1(10),11(13)-dien-6alpha,12-olide
rel-(7S,8S)-Delta8-4-hydroxy-3-methoxy-3,4-methylenedioxy-7.O.2-8.3-neolignan
2-O-(4-O-Methyl-alpha-D-glucopyranuronosyl)-D-xylose|4-Me-2-O-alpha-D-Glucopyranuronosyl-D-xylose,,
4-hydroxy-3,3-dimethoxy-4,7-epoxy-8,5-neolign-7E-en-9-al
4,5-dihydroxy-7-(4-pentenyloxy)flavanone|lawsonaringenin
(?)-(6aR,11aR)-3,4,9-trihydroxy-8-(3-methylbut-2-en-1-yl)-pterocarpan
1-hydroxy-8-(hydroxymethyl)-2-[(2Z)-4-hydroxy-3-methylbut-2-en-1-yl]-6-methyl-9H-xanthen-9-one|prenxanthone
(16S)-12,16-epoxy-11,14-dihydroxy-18-oxo-17(15?16),18(4?3)-diabeo-abieta-3,5,8,11,13-pentaene-7-one|trichotomone D
methyl 16-bromo-(7E,15E)-hexadeca-7,15-diene-5-triynoate
2-methoxy-4-(2-carboxyvinyl)phenyl alpha-L-rhamnopyranoside
3-(4,5-dimethylthiazol-2-yl)-2,5-diphenyltetrazolium bromide|formazan|renifolin D
12,16-epoxy-11,14-dihydroxy-7-oxo-18(4->3)-abeo-abieta-3,5,8,11,13-pentaen-18-al|ajudecumin B
12,16-epoxy-11,14-dihydroxy-18(4->3)-abeo-abieta-3,5,8,11,13-pentaen-2,7-dione|ajudecumin A
3,4-[(2,2-Dimethyl-3-hydroxy-3,4-dihydro-2H-1-benzopyran)-6,5-diyloxy]-3,4-dihydro-2H-1-benzopyran-7-ol
(SC2RC7)-gamma-glutamyl-S-benzylcysteine|(SC2RC7)-??-Glutamyl-S-benzylcysteine
6,7-Dimethoxy-2-(2-(4-methoxyphenyl)ethyl)chromone
2-beta-D-glucopyranosyloxy-trans-cinnamic acid methyl ester|2-beta-D-Glucopyranosyloxy-trans-zimtsaeure-methylester|Methyl o-coumarate-beta-D-glucoside
1-hydroxy-5,6-dimethoxy-7-(3-methylbut-2-enyl)-xanthen-9-one|linixanthone C
O-4-O-Methyl-alpha-D-glucuronopyranosyl-(1->3)-D-xylopyranose
(16S)-12,16-epoxy-11,14-dihydroxy-17(15-16),18(4-3)-diabeo-abieta-3,5,8,11,13-pentaene-2,7-dione ( teuvincenone E)|Teuvincenone E
(2S*,2R*,3aR*,7aS*)-2,7a-dihydroxy-6,7,3a,7a-tetrahydrospiro[1,3-benzodioxole-2,1-cyclohex-3-ene]-2,3a-dicarboxylate|(?)-idesolide|idesolide
2,3-Dimethyl-4-(1,3-benzodioxol-5-yl)-6-hydroxy-7-methoxytetralin-1-one
9-benzo[1,3]dioxol-5-yl-7,8-dimethyl-6,7,8,9-tetrahydro-naphtho[1,2-d][1,3]dioxol-9-ol|Hydroxy-otobain|hydroxyotobain|Hydroxyotobain (?) II
12,16-epoxy-6,11,14-trihydroxy-17(15-16)abeo-3alpha,18-cyclo-5,8,11,13,15-abietapentaen-7-one
1-hydroxy-3,7-dimethoxy-4-(3-methyl-but-2-enyl)-xanthen-9-one|Mbarraxanthon dimethylaether|Mbarraxanthon-dimethylaether
3-prenylnaringenin|5,7,4-trihydroxy-3-(3-methylbut-2-enyl)-flavan-4-one
5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-4,6-heptadiene-3-one
15,16-epoxy-1,3,13(16),14-clerodatetraene-17,12:18,6-diolide
7a-[2-(1,3-Benzodioxol-5-yl)-1-methylethyl]-6-(2-propenyl)-1,3-benzodioxol-5(7aH)-one
Trijuganone C
Trijuganone C is a natural product found in Salvia miltiorrhiza, Salvia trijuga, and Salvia miltiorrhiza var. miltiorrhiza with data available.
7-CHLORO-6-[4-(DIETHYLAMINO)PHENYL]QUINOLINE-5,8-DIONE
2-hydroxyneobavaisoflavanone
A hydroxyisoflavanone that is 2,3-dihydroneobavaisoflavone with an additional hydroxy group at position 2. Isolated from Erythrina lysistemon, it exhibits anti-HIV activity.
broussochalcone
Broussochalcone A is a natural product found in Broussonetia papyrifera with data available.
Zuihonin A
Zuihonin A is a natural product found in Saururus cernuus, Chamaecyparis obtusa, and other organisms with data available.
rel-(8R,8R)-Dimethyl-(7S,7R)-bis(3,4-methylenedioxyphenyl)tetrahydro-furan
rel-(8R,8'R)-Dimethyl-(7S,7'R)-bis(3,4-methylenedioxyphenyl)tetrahydro-furan is a chemical constituent of the fruit of Myristica fragrans. rel-(8R,8'R)-Dimethyl-(7S,7'R)-bis(3,4-methylenedioxyphenyl)tetrahydro-furan is a chemical constituent of the fruit of Myristica fragrans.
d-epigalbacin
(-)-Zuonin A is a natural product found in Saururus chinensis with data available. (-)-Zuonin A (D-Epigalbacin), a naturally occurring lignin, is a potent, selective JNKs inhibitor, with IC50s of 1.7 μM, 2.9 μM and 1.74 μM for JNK1, JNK2 and JNK3, respectively[1]. (-)-Zuonin A (D-Epigalbacin), a naturally occurring lignin, is a potent, selective JNKs inhibitor, with IC50s of 1.7 μM, 2.9 μM and 1.74 μM for JNK1, JNK2 and JNK3, respectively[1]. (-)-Zuonin A (D-Epigalbacin), a naturally occurring lignin, is a potent, selective JNKs inhibitor, with IC50s of 1.7 μM, 2.9 μM and 1.74 μM for JNK1, JNK2 and JNK3, respectively[1]. (-)-Zuonin A (D-Epigalbacin), a naturally occurring lignin, is a potent, selective JNKs inhibitor, with IC50s of 1.7 μM, 2.9 μM and 1.74 μM for JNK1, JNK2 and JNK3, respectively[1].
1,6-Dihydro-4,7-epoxy-1-methoxy-3,4-methylenedioxy-6-oxo-3,8-lignan
CID 101282026 is a natural product found in Ocotea porosa, Aniba terminalis, and Magnolia denudata with data available.
CID 129316722
4-[5-(4-hydroxy-3-methoxyphenyl)-3,4-dimethylfuran-2-yl]-2-methoxyphenol
5,7-dihydroxy-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-2,3-dihydrochromen-4-one
alpha-(o-Nitro-p-tolylazo)acetoacetanilide
http://casmi-contest.org/challenges-cat1-2.shtml; CASMI2012 LC Challenge 12
Arylbenzofuran flavonoid base + 3O, 1MeO, 1Prenyl
Annotation level-3
3-(2-Hydroxy-3-methylbut-3-enyl)-4,2,4-trihydroxychalcone
N-(6-Aminohexyl)-1-chloro-naphthalene-5-sulfonamide
LINOCINNAMARIN
Oenanthoside A
1-Hydroxy-3,5-dimethoxy-2-prenylxanthone
Dracocephalumoid E
(2S,1S)-2-CYCLOPROPYL-2-(1-PHENYLETHYLAMINO)ACETICACID
Nilofabicin
C254 - Anti-Infective Agent > C258 - Antibiotic
4-(5-methoxy-3-phenyl-1,6-naphthyridin-2-yl)benzaldehyde
ETHYL 3-(SEC-BUTYLTHIO)-6,6-DIMETHYL-4-OXO-4,5,6,7-TETRAHYDROBENZO[C]THIOPHENE-1-CARBOXYLATE
5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]pyrazole-3-carboxylic acid
3-methoxy-4-[(1-methyl-5-nitroindol-3-yl)methyl]benzoic acid
BENZYL (2-((1,3-DIOXOISOINDOLIN-2-YL)OXY)ETHYL)CARBAMATE
ETHYL 2-(3-CHLORO-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENOXY)ACETATE
3-(2-BIPHENYL-4-YL-IMIDAZO[1,2-A]PYRIDIN-3-YL)-ACRYLIC ACID
3-(3-CARBAMOYL-BENZENESULFONYL)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
3-(4-CARBAMOYL-BENZENESULFONYL)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
2-(2,4-BIS(TRIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
3-hydroxy-N-[(Z)-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]naphthalene-2-carbohydrazide,hydrate
1-Naphthalenecarboxaldehyde,2-hydroxy-, 2-[(2-hydroxy-1-naphthalenyl)methylene]hydrazone
2-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
3H-Thieno[2,3-d]imidazole-5-carboxylic acid,3-cyclohexyl-6-methyl-2-phenyl-
(3aR,4R,5R,6aS)-4-((E)-4-(3-chlorophenoxy)-3-hydroxybut-1-en-1-yl)hexahydro-2H-cyclopenta[b]furan-2,5-diol
(2S)-1-[4-(2-acetamidoethyl)phenyl]sulfonylproline
methyl sulfate,prop-2-enamide,trimethyl(2-prop-2-enoyloxyethyl)azanium
5-(2-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
4-PHENYL-1-(P-TOLYLSULPHONYL)PIPERIDINE-4-CARBONITRILE
3-(3-(4-(2-methoxyethoxy)phenyl)-1,2,4-oxadiazol-5-yl)benzoicacid
Enarodustat
C78275 - Agent Affecting Blood or Body Fluid Enarodustat is a potent and orally active hypoxia-inducible factor prolyl hydroxylase inhibitor, with an EC50 of 0.22 μM. Enarodustat has the potential for renal anemia treatment.
5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
(2R/S)-6-PNG (6-Prenylnaringenin) is a potent and reversible Cav3.2 T-type Ca2+ channels (T-channels) blocker. (2R/S)-6-PNG can penetrate the blood-brain barrier (BBB). (2R/S)-6-PNG suppresses neuropathic and visceral pain in mice[1].
3-Ketolactose
A keto-disaccharide that is beta-D-galactosyl-(1->4)-beta-D-glucose in which the hydroxy group at position 3 of the galactosyl moiety has been oxidised to the corresponding ketone.
3,4-Dimethyl-2,5-bis(4-hydroxy-3-methoxyphenyl)furan
N-[amino-[2-(1H-indol-3-yl)ethylimino]methyl]-4-chlorobenzamide
N-(6-aminohexyl)-5-chloronaphthalene-2-sulfonamide
N-(5-methyl-3-isoxazolyl)-2-[[6-(4-methylphenyl)-3-pyridazinyl]thio]acetamide
1,2,4-Triazolo(4,3-a)pyridine, 6-(4-(2,5-difluorophenyl)-5-oxazolyl)-3-(1-methylethyl)-
1-(N-Imidazolyl)-2-hydroxy-2-(2,3-dichlorophenyl)octane
3,4,5-Trihydroxy-6-(2,3,5-trihydroxy-6-methyloxan-4-yl)oxyoxane-2-carboxylic acid
Protodeoxyviolaceinate
A monocarboxylic acid anion that is the conjugate base of protodeoxyviolaceinic acid, resulting from the removal of the proton from the carboxy group. Major structure at pH 7.3.
Galactopyranose, 6-deoxy-4-O-beta-D-glucopyranuronosyl-, L-
3,4,4a,9a-tetrahydro-6,7-dimethylspiro[benzofuran-3(2H),2-pyrano[2,3-b]benzofuran]-2,4a-diol
A natural product found in Eupatorium cannabinum subspecies asiaticum.
7-Amino-5-(4-ethoxy-3-methoxyphenyl)-4-oxo-3,5-dihydropyrano[2,3-d]pyrimidine-6-carbonitrile
2,5-dimethyl-4-nitro-N-[4-(1-pyrazolylmethyl)phenyl]-3-pyrazolecarboxamide
N-(1,3-benzodioxol-5-yl)-1-[(4-fluorophenyl)methyl]-4-triazolecarboxamide
N-[4-(1,3-benzothiazol-2-yl)phenyl]-N-methylcarbamic acid tert-butyl ester
4-[[(1-Methylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester
2-fluoro-N-[2-(2-methylpropyl)-1,3-dioxo-5-isoindolyl]benzamide
4-(4-Ethoxyphenyl)-1-(4-methoxyphenyl)-2-(methylthio)imidazole
6-(3,4-Dimethoxyphenyl)-4-methoxy-1,3-dimethyl-8-cyclohepta[c]furanone
3,4-dimethyl-N-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-sulfanylidenemethyl]benzamide
5-Chloro-4-(4-ethylphenoxy)-2-(4-methylphenyl)-3-pyridazinone
1-(4-Fluorophenyl)-2-[(2-propyl-4-quinazolinyl)thio]ethanone
N-[3,4-dihydro-2H-quinolin-1-yl(sulfanylidene)methyl]-2-(3-methylphenoxy)acetamide
N-[(E)-(1-acetylindol-3-yl)methylideneamino]-2,4-dimethyl-1,3-thiazole-5-carboxamide
(2S,3R,4R,5R,6S)-4,5,6-trihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxane-2-carboxylic acid
(3S)-7-chloro-1-(cyclopropylmethyl)-3-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-one
(2R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-one
6-(2-Benzyl-3-oxopropoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
2-methoxy-4-[(Z)-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylhydrazinylidene)methyl]phenol
3,4,5-Trihydroxy-6-[(2-methyl-3-phenyloxiran-2-yl)methoxy]oxane-2-carboxylic acid
3,4,5-Trihydroxy-6-[1-(3-phenyloxiran-2-yl)ethoxy]oxane-2-carboxylic acid
(1-Phosphonooxy-3-propanoyloxypropan-2-yl) heptanoate
(1-Butanoyloxy-3-phosphonooxypropan-2-yl) hexanoate
Diphacinone
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
methyl (E)-3-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate
3-O-(4-O-Methyl-a-D-glucopyranuronosyl)-L-arabinose
4-O-(4-O-Methyl-alpha-D-glucopyranuronosyl)-L-arabinose
coniferaldehyde beta-D-glucoside
A beta-D-glucoside that is coniferaldehyde in which the phenolic hydrogen has been replaced by a beta-D-glucosyl residue.
EA4
EA4, a derivative of quinone, is an inhibitor for both rPLA and cPLA. EA4 can inhibit rPLA2 with a Ki value of 130 μM. EA4 can be used for the research of hemostasis, thrombosis, and erythropoiesis[1].
Syk Inhibitor II
Syk Inhibitor II is a potent, high selective and ATP-competitive Syk inhibitor with an IC50 of 41 nM. Syk Inhibitor II inhibits 5-HT release from RBL-cells with an IC50 of 460 nM. Syk Inhibitor II shows less potent against other kinases and has anti-allergic effect[1].
(1r,3s,5s,9r)-3-hydroxy-1,5-dimethyl-13-oxapentacyclo[10.6.1.0²,¹⁰.0⁵,⁹.0¹⁵,¹⁹]nonadeca-2(10),12(19),14-triene-6,11,16-trione
(2r,3r,3as)-2-(2h-1,3-benzodioxol-5-yl)-3a-methoxy-3-methyl-5-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-one
(2z)-1-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-hydroxy-3-(4-hydroxyphenyl)prop-2-en-1-one
8-hydroxy-1-(hydroxymethyl)-3-methyl-2-[(3-methylbut-2-en-1-yl)oxy]xanthen-9-one
1-{2,6-dihydroxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}-3-(4-hydroxyphenyl)prop-2-en-1-one
8,10-dihydroxy-2,5,5-trimethyl-3,4,4a,12b-tetrahydro-6-oxatetraphene-7,12-dione
1-hydroxy-2-(4-hydroxy-3-methylbut-2-en-1-yl)-8-(hydroxymethyl)-6-methylxanthen-9-one
(1r,10s)-15-[(2r)-2-hydroxy-3-methylbut-3-en-1-yl]-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2,4,6,11(16),12,14-hexaene-5,14-diol
(3s,7r,12r)-3,7,12-trihydroxy-8-methoxy-3-methyl-2,4,7,12-tetrahydrotetraphen-1-one
2',7a-dimethyl 2',3a-dihydroxy-4,5-dihydrospiro[1,3-benzodioxole-2,1'-cyclohexan]-3'-ene-2',7a-dicarboxylate
7-acetyl-3,8,9-trihydroxy-2,4,4,6-tetramethylanthracen-1-one
(4ar,5s,8r,8as)-5,8-dihydroxy-2,3,4a,5,6,7,8,8a-octahydro-2',4'-dioxaspiro[naphthalene-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),5',7',9',11'-pentaen-4-one
5'-ethenyl-3',5,5'-trimethyl-3',3'a,6',6'a-tetrahydrospiro[1-benzopyran-3,4'-cyclopenta[b]furan]-2,2',4-trione
7,8,10-trimethoxy-12-phenyl-5,13-dioxatricyclo[7.4.0.0²,⁶]trideca-1,3,6,8-tetraene
5-{[4-(2h-1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methyl}-2h-1,3-benzodioxole
2-[2,6-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-3-hydroxy-5-methylbenzaldehyde
1,2-dimethyl-3,8,15-trioxahexacyclo[11.7.1.0²,⁴.0⁶,¹⁰.0⁶,²¹.0¹⁴,¹⁸]henicosa-10,14(18),16-triene-9,19-dione
(3s,5r)-12-hydroxy-5-methyl-10-(2-phenylethyl)-4,7-dioxatricyclo[6.4.0.0³,⁵]dodeca-1(12),8,10-triene-11-carboxylic acid
5-[5-(2h-1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2h-1,3-benzodioxole
(2s)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(3-methylbut-2-en-1-yl)oxy]-2,3-dihydro-1-benzopyran-4-one
2-ethoxy-5-hydroxy-6-methyl-4-oxooxan-3-yl 2,4-dihydroxy-6-methylbenzoate
5-{[(3s,4s)-4-(2h-1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methyl}-2h-1,3-benzodioxole
(1r,7s)-7-[(r)-2h-1,3-benzodioxol-5-yl(hydroxy)methyl]-6-methoxy-7-methyl-3-(prop-2-en-1-yl)bicyclo[3.1.1]hepta-3,5-dien-2-one
(5r,12s)-8-hydroxy-12-(4-hydroxyphenyl)-5,6,6-trimethyl-4,13-dioxatricyclo[7.4.0.0³,⁷]trideca-1(9),2,7-trien-10-one
7-(furan-3-yl)-9-methyl-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadeca-4,13-diene-3,15-dione
methyl 3-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate
6-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-naphthalen-1-one
(2e)-3-(3,4-dihydroxyphenyl)-1-(5-hydroxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl)prop-2-en-1-one
7a-[1-(2h-1,3-benzodioxol-5-yl)propan-2-yl]-6-(prop-2-en-1-yl)-2h-1,3-benzodioxol-5-one
methyl (2e)-3-{3-hydroxy-5-[(3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}prop-2-enoate
(1r,12r)-7-(2-hydroxypropan-2-yl)-6,11,19-trioxapentacyclo[10.8.0.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2(10),3,5(9),13,15,17-hexaen-16-ol
(4br,10as)-4b,8,9-trihydroxy-7-methoxy-11,11-dimethyl-10h,10ah-benzo[b]fluoren-5-one
(4s,7r,9r,10s)-7-(furan-3-yl)-9-methyl-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadeca-11,13-diene-5,15-dione
(2r,11r,16r)-17,17-dimethyl-4,12,18-trioxapentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-1(21),5,7,9,13,19-hexaene-7,16-diol
(5r)-5-[(4r,6s)-4-hydroxy-2',4'-dioxaspiro[cyclohexane-1,3'-tricyclo[7.3.1.0⁵,¹³]tridecane]-1'(13'),5',7',9',11'-pentaen-6-yl]oxolan-2-one
3,7,12-trihydroxy-8-methoxy-3-methyl-2,4,7,12-tetrahydrotetraphen-1-one
(4s)-4-(3,4-dihydroxyphenyl)-12,12-dimethyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8-trien-6-one
(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{[(2s,3r,4r,5s,6s)-2,3,5-trihydroxy-6-methyloxan-4-yl]oxy}oxane-2-carboxylic acid
methyl (2e)-4-{4,8-dimethoxy-9h-pyrido[3,4-b]indol-1-yl}-4-oxobut-2-enoate
(1s,16s,17s)-5,17-dihydroxy-1-methyl-14-oxapentacyclo[11.6.1.0²,¹¹.0⁴,⁹.0¹⁶,²⁰]icosa-2,4(9),10,13(20)-tetraene-8,12-dione
3-(4-hydroxyphenyl)-1-[2,4,6-trihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]prop-2-en-1-one
(4z,6e)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)hepta-4,6-dien-3-one
5,17-dihydroxy-1-methyl-14-oxapentacyclo[11.6.1.0²,¹¹.0⁴,⁹.0¹⁶,²⁰]icosa-2,4(9),10,13(20)-tetraene-8,12-dione
5,7-dihydroxy-2-(4-hydroxyphenyl)-8-(2-methylbut-3-en-2-yl)-2,3-dihydro-1-benzopyran-4-one
(3r,4s)-3-(5-hydroxy-2,2-dimethylchromen-6-yl)-3,4-dihydro-2h-1-benzopyran-4,7-diol
10-(2h-1,3-benzodioxol-5-yl)-3-methoxy-11-methyl-7-oxatricyclo[6.3.1.0¹,⁶]dodeca-2,5-dien-4-one
7-(furan-3-yl)-9-methyl-6,16-dioxatetracyclo[8.7.0.0¹,¹⁴.0⁴,⁹]heptadeca-3,13-diene-5,15-dione
(3r)-3-(2,4-dihydroxyphenyl)-7-hydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
(2s,3s)-2-(2h-1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-7-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-ol
(1s,5r,16s,17s)-5,17-dihydroxy-1-methyl-14-oxapentacyclo[11.6.1.0²,¹¹.0⁴,⁹.0¹⁶,²⁰]icosa-2,4(9),10,13(20)-tetraene-8,12-dione
3-(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enal
2-(2h-1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-7-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-ol
(2s)-7-{[(2r)-3,3-dimethyloxiran-2-yl]methoxy}-5-hydroxy-2-phenyl-2,3-dihydro-1-benzopyran-4-one
5-[(2r,3s,4r,5r)-5-(2h-1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2h-1,3-benzodioxole
1-[4-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-3-(4-hydroxyphenyl)prop-2-en-1-one
methyl (2e)-3-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate
(2s,3r)-1,4-bis(2h-1,3-benzodioxol-5-yl)-2,3-dimethylbutan-1-one
(2s,3s,5s)-2-(2h-1,3-benzodioxol-5-yl)-5-methoxy-3-methyl-5-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-one
5-[(2s,3s,4s,5r)-5-(2h-1,3-benzodioxol-5-yl)-3,4-dimethyloxolan-2-yl]-2h-1,3-benzodioxole
3-phenyl-1-(4,6,7-trimethoxy-1-benzofuran-5-yl)propan-1-one
2,4,2',4'-tetrahydroxy-3'-prenylchalcone
{"Ingredient_id": "HBIN004188","Ingredient_name": "2,4,2',4'-tetrahydroxy-3'-prenylchalcone","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "CC(=CCC1=C(C=CC(=C1O)C(=O)C=CC2=C(C=C(C=C2)O)O)O)C","Ingredient_weight": "340.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21135","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "69906284","DrugBank_id": "NA"}
(2s)-euchrenone a7
{"Ingredient_id": "HBIN006805","Ingredient_name": "(2s)-euchrenone a7","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "CC(=CCC1=C(C=CC2=C1OC(CC2=O)C3=C(C=C(C=C3)O)O)O)C","Ingredient_weight": "340.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7484","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44593508","DrugBank_id": "NA"}
3',4,4',5-tetrahydroxy-2,7'-cyclolignan-7-one; (7'r,8s,8's)-form,4,5-methylene,3'-me ether
{"Ingredient_id": "HBIN007221","Ingredient_name": "3',4,4',5-tetrahydroxy-2,7'-cyclolignan-7-one; (7'r,8s,8's)-form,4,5-methylene,3'-me ether","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "NA","Ingredient_weight": "340.37","OB_score": "NA","CAS_id": "93710-74-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8354","PubChem_id": "NA","DrugBank_id": "NA"}
5-prenylbutein
{"Ingredient_id": "HBIN011884","Ingredient_name": "5-prenylbutein","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "CC(=CCC1=C(C(=CC(=C1)C=CC(=O)C2=C(C=C(C=C2)O)O)O)O)C","Ingredient_weight": "340.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "17813","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11267805","DrugBank_id": "NA"}
6,7-dimethoxy-2-[2-(4'-methoxyphenyl)-ethyl]chromone
{"Ingredient_id": "HBIN012074","Ingredient_name": "6,7-dimethoxy-2-[2-(4'-methoxyphenyl)-ethyl]chromone","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "COC1=CC=C(C=C1)CC(C2=CC3=C(C=C2)OC=CC3=O)(OC)OC","Ingredient_weight": "340.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6257","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "129829701","DrugBank_id": "NA"}
agastaquinone
{"Ingredient_id": "HBIN014829","Ingredient_name": "agastaquinone","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "CC(C)C1=C(C(=O)C2=C3C=CC(=O)C(C3=CC(=C2C1=O)O)(C)C)OC","Ingredient_weight": "340.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7115","PubChem_id": "177257","DrugBank_id": "NA"}
blepharolide b
{"Ingredient_id": "HBIN018653","Ingredient_name": "blepharolide b","Alias": "NA","Ingredient_formula": "C20H20O5","Ingredient_Smile": "CC1C2CC=CC3C2(CCC4=C1C(OC4=O)C5=COC=C5)COC3=O","Ingredient_weight": "340.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2502","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "15479020","DrugBank_id": "NA"}
