Exact Mass: 326.1148
Exact Mass Matches: 326.1148
Found 500 metabolites which its exact mass value is equals to given mass value 326.1148,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
MethylophiopogononeB
Methylophiopogonone B is a homoisoflavonoid that is 4H-1-benzopyran-4-one substituted by hydroxy groups at positions 5 and 7, methyl groups at positions 6 and 8 and a (4-methoxyphenyl)methyl group at position 3 respectively. It has a role as a plant metabolite. It is a homoisoflavonoid, a member of resorcinols and a monomethoxybenzene. Methylophiopogonone B is a natural product found in Ophiopogon japonicus with data available. A homoisoflavonoid that is 4H-1-benzopyran-4-one substituted by hydroxy groups at positions 5 and 7, methyl groups at positions 6 and 8 and a (4-methoxyphenyl)methyl group at position 3 respectively. Methylophiopogonone B, a homoisoflavonoidal compound that could be isolated from Ophiopogonis Tiber, could scavenge ?OH and H2O2 in vitro to a certain extent[1][2]. Methylophiopogonone B, a homoisoflavonoidal compound that could be isolated from Ophiopogonis Tiber, could scavenge ?OH and H2O2 in vitro to a certain extent[1][2].
Neohesperidoside
Neohesperidoside, also known as 2-O-alpha-L-rhamnopyranosyl-D-glucopyranose or alpha-L-rhap-(1->2)-beta-D-glcp, is a member of the class of compounds known as O-glycosyl compounds. O-glycosyl compounds are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. Neohesperidoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Neohesperidoside can be found in lemon, which makes neohesperidoside a potential biomarker for the consumption of this food product. Neohesperidoside is the disaccharide which is present in some flavonoids. It can be found in species of typha, in species of typha angustifolia . Alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranose is a disaccharide consisting of alpha-L-rhamnose and beta-D-glucose linked via a 1->2 glycosidic bond. It has a role as a metabolite. 2-O-alpha-L-Rhamnopyranosyl-D-glucopyranose is a natural product found in Trypanosoma brucei with data available.
6,7-Dimethyl-8-(1-D-ribityl)lumazine
6,7-Dimethyl-8-(1-D-ribityl)lumazine belongs to the class of organic compounds known as pteridines and derivatives. These are polycyclic aromatic compounds containing a pteridine moiety, which consists of a pyrimidine fused to a pyrazine ring to form pyrimido(4,5-b)pyrazine. 6,7-Dimethyl-8-(1-D-ribityl)lumazine is an extremely weak basic (essentially neutral) compound (based on its pKa). 6,7-Dimethyl-8-(1-D-ribityl)lumazine exists in all living organisms, ranging from bacteria to humans. In humans, 6,7-dimethyl-8-(1-D-ribityl)lumazine is involved in riboflavin metabolism. Outside of the human body, 6,7-dimethyl-8-(1-D-ribityl)lumazine has been detected, but not quantified in, several different foods, such as quinoa, arrowhead, conchs, watermelons, and Elliotts blueberries. This could make 6,7-dimethyl-8-(1-D-ribityl)lumazine a potential biomarker for the consumption of these foods. 6,7-Dimethyl-8-(1-D-ribityl)lumazine is an intermediate in riboflavin metabolism. 6,7-Dimethyl-8-(1-D-ribityl)lumazine is the second to last step in the synthesis of ribitol and is converted from 4-(1-D-ribitylamino)-5-amino-2,6-dihydroxypyrimidine via the enzyme riboflavin synthase beta chain. It is then converted into riboflavin via the enzyme riboflavin synthase alpha chain (EC 2.5.1.9). 6,7-Dimethyl-8-(1-D-ribityl)lumazine is an intermediate in riboflavin metabolism. 6,7-Dimethyl-8-(1-D-ribityl)lumazine is the second to last step in the synthesis of ribitol and is converted from 4-(1-D-ribitylamino)-5-amino-2,6-dihydroxypyrimidine via the enzyme riboflavin synthase beta chain. It is then
Humilixanthin
Iso. from the yellow-coloured root of beetroot Beta vulgaris. Humilixanthin is found in common beet and root vegetables. Humilixanthin is found in common beet. Iso. from the yellow-coloured root of beetroot Beta vulgaris.
3-O-alpha-D-glucopyranosyl-L-rhamnopyranose
Rutinose
Rutinose, also known as 6-O-(6-deoxy-alpha-L-mannopyranosyl)-D-glucose or (α-rhamnopyranosyl-β-glucopyranose, is a member of the class of compounds known as O-glycosyl compounds. O-glycosyl compounds are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. Rutinose is soluble (in water) and a very weakly acidic compound (based on its pKa). Rutinose can be found in capers, which makes rutinose a potential biomarker for the consumption of this food product.
Moracin P
Moracin P is a member of benzofurans. Moracin P is a natural product found in Morus alba with data available. Moracin P is found in fruits. Moracin P is a constituent of Morus alba (white mulberry). Constituent of Morus alba (white mulberry). Moracin P is found in mulberry and fruits. Moracin P is a 2-arylbenzofuran isolated from the Mori Cortex Radicis. Moracin P exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin P reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin P has neuroprotective and anti-inflammatory effects[1][2][3]. Moracin P is a 2-arylbenzofuran isolated from the Mori Cortex Radicis. Moracin P exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin P reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin P has neuroprotective and anti-inflammatory effects[1][2][3].
Moracin O
Moracin O is a member of benzofurans. Moracin O is a natural product found in Morus cathayana, Morus lhou, and Morus alba with data available. Moracin O is found in fruits. Moracin O is a constituent of Morus alba (white mulberry). Constituent of Morus alba (white mulberry). Moracin O is found in fruits. Moracin O is a 2-arylbenzofuran isolated from the Morus alba Linn. . Moracin O exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin O reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin O has neuroprotective and anti-inflammatory effects[1][2][3]. Moracin O is a 2-arylbenzofuran isolated from the Morus alba Linn. . Moracin O exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin O reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin O has neuroprotective and anti-inflammatory effects[1][2][3]. Moracin O is a 2-arylbenzofuran isolated from the Morus alba Linn. . Moracin O exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin O reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin O has neuroprotective and anti-inflammatory effects[1][2][3].
Neohesperidose
Neohesperidose is found in citrus. Neohesperidose occurs in plants as disaccharide component of
1,6-Dihydroxy-3-methoxy-2-prenylxanthone
1,6-Dihydroxy-3-methoxy-2-prenylxanthone is found in fruits. 1,6-Dihydroxy-3-methoxy-2-prenylxanthone is a constituent of Garcinia mangostana (mangosteen). Constituent of Garcinia mangostana (mangosteen). 1,6-Dihydroxy-3-methoxy-2-prenylxanthone is found in fruits.
1,5-Bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one
1,5-bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one is found in herbs and spices. 1,5-bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one is a constituent of the rhizomes of Curcuma domestica (turmeric). Constituent of the rhizomes of Curcuma domestica (turmeric). 1,5-bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one is found in turmeric and herbs and spices.
omega-Hydroxymoracin N
omega-Hydroxymoracin N is found in fruits. omega-Hydroxymoracin N is a constituent of the leaves of Morus alba (white mulberry) (famine food). Constituent of the leaves of Morus alba (white mulberry) (famine food). omega-Hydroxymoracin N is found in fruits.
1,5-Dihydroxy-3-methoxy-2-prenylxanthone
1,5-Dihydroxy-3-methoxy-2-prenylxanthone is found in fruits. 1,5-Dihydroxy-3-methoxy-2-prenylxanthone is obtained from fruit hulls of Garcinia mangostana (mangosteen
1,7-Dihydroxy-3-methoxy-2-prenylxanthone
1,7-Dihydroxy-3-methoxy-2-prenylxanthone is found in fruits. 1,7-Dihydroxy-3-methoxy-2-prenylxanthone is isolated from fruit hulls of Garcinia mangostana (mangosteen
2-O-a-L-Fucopyranosyl-galactose
2-O-a-L-Fucopyranosyl-galactose is a disaccharide found in human breast milk that acts as an acceptor for N-acetylgalactosamine via alpha-galactosyltransferase activity (PMID:15158661).
3-O-a-L-Fucopyranosyl-D-glucose
3-O-alpha-L-Fucopyranosyl-D-glucose is a fucosylated oligosaccharide specific to human milk that form part of the innate immune system. contributing to the protection by breast-feeding of the newborn against enteric diseases through the mechanism of preventing the attachment of pathogenic bacteria to the duodenual epithelium. (PMID 1579031) [HMDB] 3-O-alpha-L-Fucopyranosyl-D-glucose is a fucosylated oligosaccharide specific to human milk that form part of the innate immune system. contributing to the protection by breast-feeding of the newborn against enteric diseases through the mechanism of preventing the attachment of pathogenic bacteria to the duodenual epithelium. (PMID 1579031).
6-O-b-D-Fructofuranosyl-2-deoxy-D-glucose
6-O-b-D-Fructofuranosyl-2-deoxy-D-glucose is found in brassicas. 6-O-b-D-Fructofuranosyl-2-deoxy-D-glucose is isolated from horseradish and peas which had been fed 2-deoxyglucose. Isolated from horseradish and peas which had been fed 2-deoxyglucose. 6-O-b-D-Fructofuranosyl-2-deoxy-D-glucose is found in brassicas and pulses.
(1E,4E)-1,5-Bis(4-hydroxy-3-methoxyphenyl)penta-1,4-dien-3-one
3-Hydroxydesloratadine
6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranose
Aspirin eugenol ester
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
Etomoxir
D007004 - Hypoglycemic Agents D004791 - Enzyme Inhibitors
(2R,3R,4S,5R)-2-(Hydroxymethyl)-6-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxane-3,4,5-triol
Ethyl 8-azido-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
Eucalyptin
Eucalyptin is a natural product found in Myrcia citrifolia, Myrcia glabra, and other organisms with data available.
1,5-Dihydroxy-1,7-bis(4-hydroxyphenyl)-4,6-heptadien-3-one
3-Hydroxy-1,7-bis(4-hydroxyphenyl)-6-heptene-1,5-dione
1-Methoxy-2,5-dihydroxy-4-(1,1-dimethyl-2-propenyl)xanthone
Me glycoside-alpha-Pyranose-2-O-beta-D-Xylopyranosyl-D-mannose
Me glycoside-beta-Pyranose-2-O-beta-D-Glucopyranosyl-L-arabinose
Me glycoside-alpha-alpha-Furanose-2-O-beta-D-Glucopyranosyl-L-arabinose
2-(Butoxymethyl)-1,3-dihydroxyanthracene-9,10-dione
1,6-(2-Oxoindoline-3,3-diyltrimethylene)-2-methyl-4(1H)-oxo-5,6-dihydronicotinic acid
2-(3-Methoxy-4-hydroxyphenethyl)-6-methoxychromone
3,4-dideoxy-6-O-alpha-D-galactopyranosyl-D-erythro-hexonic acid
methyl beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|Methyl ??-D-apiofuranosyl-(1鈥樏傗垎6)-??-D-glucopyranoside
3-methoxy-4-[(2S,3R)-3-methyl-7-(1-propynyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-1,2-benzenediol
3-O-(3,4-Dihydroxycinnamoyl),Me ester-2,3,4-Trihydroxy-2-methylbutanoic acid,
3,4-dihydro-7-(6-hydroxy-2-benzofuranyl)-2,2-dimethyl-2H-1-benzopyran-3,5-diol|wittifuran W
4-Methylbenzenesulfonyl-(4R, 6S)-1, 7-Dioxaspiro[5.5]undecan-4-ol
1,5-dihydroxy-3-methoxy-4-(3-methylbut-2-enyl)xanthone
(4E,6E)-1,7-bis(3,4-dihydroxyphenyl)hepta-4,6-dien-3-one|1,7-bis(3,4-dihydroxyphenyl)hepta-4E,6E-dien-3-one
(4S,5S,8S,9R,10S)-8,9,10-trihydroxy-4-[4-hydroxy-3-methoxyphenyl]-1,6-dioxaspiro[4,5]decan-2-one|foveospirolide
4-O-(p-coumaroyl)-D-glucopyranose|4-O-p-Cumaroyl-glucopyranose|4-p-Cumaroyl-glucose
7-((2E)-4-(4,5-dihydro-3-methylene-2-oxo-5-furanyl)-3-methylbut-2-enyloxy)coumarin|clauslactone E|excavarin-A
3-(3-Hydroxy-2,4-dimethoxyphenyl)-3,4-dihydro-2H-furo[2,3-h]-1-benzopyran
3-[(3,4-dimethoxyphenyl)methylidene]-7-methoxy-3,4-dihydro-2H-1-benzopyran-4-one
2-O-(3,4-Dihydroxycinnamoyl),Me ester-2,3,4-Trihydroxy-2-methylbutanoic acid,
2,3-Dihydro-3-(3,4-Dimethoxyphenyl)-2-methyl-5,6-methylenedioxyindenone
2-deoxysucrose|2-Desoxy-alpha-D-glucopyranosyl-beta-D-fructofuranosid|2G-deoxysucrose
(5-O-feruloyl)-L-arabinose|5-O-(E)-feruloyl-L-arabinofuranose|5-O-(trans-feruloyl)-alpha-L-arabinofuranose|5-O-(trans-feruloyl)-L-arabinofuranose|5-O-(trans-feruloyl)-L-Araf|5-O-trans-feruloyl-L-arabinofuranose
(1R,2S)-1,2-epoxyneomajucin|(1S,2R,4S,6S,7S,11R,12R,15R)-6,11,15-trihydroxy-2,7-dimethyl-3,9,13-trioxapentacyclo[10.3.1.01,6.02,4.07,11]hexadecane-10,14-dione|1,2-epoxyneomajucin
1,2:3,5-Di-O-benzoyidene(second isomer)-alpha-D-Furanose-Xylose|1,2:3,5-Di-O-benzoyidene-alpha-D-Furanose-Xylose
[4-(7-acetyloxy-3,4-dihydro-2H-chromen-3-yl)phenyl] acetate
6beta-acetoxy-7alpha-chloroconfertifoline|7alpha-chloro-dihydrocinnamosmolide
2-O-alpha-D-Galactopyranosyl-L-rhamnose|2-O-beta-D-Galactopyranosyl-L-rhamnose|2-O-beta-D-Glucopyranosyl-L-rhamnose|alpha-Pryanose-form-2-O-alpha-D-Galactopyranosyl-L-rhamnose
1,8-Dihydroxy-3-[(3-methyl-2-butenyl)oxy]-6-methyl-9H-xanthene-9-one
scriptaid
D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors
1-[(Z)-but-2-en-2-yl]-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one
(E)-3-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid
3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-hydroxy-4-methoxyphenyl]propanoic acid
Melilotoside
C19H18O5_1-[2-(1,3-Benzodioxol-5-yl)-3-methyl-1-benzofuran-5-yl]-1,2-propanediol
C15H18O8_2-Propenoic acid, 3-[4-(beta-D-glucopyranosyloxy)phenyl]-, (2E)
C15H18O8_beta-D-Glucopyranose, 1-O-[(2E)-3-(2-hydroxyphenyl)-1-oxo-2-propen-1-yl]
(E)-3-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid
7-[(E)-3-methyl-4-(4-methyl-5-oxo-2H-furan-2-yl)but-2-enoxy]chromen-2-one
(E)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid
(1S,4R,7S,8S,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione
1-[2-(1,3-benzodioxol-5-yl)-3-methyl-1-benzofuran-5-yl]propane-1,2-diol
3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-hydroxy-4-methoxyphenyl]propanoic acid
7-[(E)-3-methyl-4-(4-methyl-5-oxo-2H-furan-2-yl)but-2-enoxy]chromen-2-one_major
(1S,4R,7S,8S,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione_major
3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-hydroxy-4-methoxyphenyl]propanoic acid_major
(E)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid_major
3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-hydroxy-4-methoxyphenyl]propanoic acid_22.6\\%
1-[2-(1,3-benzodioxol-5-yl)-3-methyl-1-benzofuran-5-yl]propane-1,2-diol_15.2\\%
1-[2-(1,3-benzodioxol-5-yl)-3-methyl-1-benzofuran-5-yl]propane-1,2-diol_major
(1S,4R,7S,8S,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione_75.9\\%
(1S,4R,7S,8S,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione_78.0\\%
5H-Benzo[5,6]cyclohepta[1,2-b]pyridin-6-ol, 8-chloro-6,11-dihydro-11-(4-piperidinylidene)-
5-Hydroxy Desloratadine
2H-Benzo[5,6]cyclohepta[1,2-b]pyridin-2-one, 8-chloro-1,5,6,11-tetrahydro-11-(4-piperidinylidene)-
1,5-Dihydroxy-3-methoxy-2-prenylxanthone
1,7-Dihydroxy-3-methoxy-2-prenylxanthone
1,6-Dihydroxy-3-methoxy-2-prenylxanthone
Egonol
A member of the class of 1-benzofurans that is 1-benzofuran substituted by a methoxy group at position 7, a 1,3-benzodioxol-5-yl group at position 2 and a 3-hydroxypropyl group at position 5. It has been isolated from Styrax agrestis.
1-O-p-Coumaroyl-beta-D-glucose
trans-p-Coumaric acid 4-glucoside
Moracin O
Moracin O is a 2-arylbenzofuran isolated from the Morus alba Linn. . Moracin O exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin O reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin O has neuroprotective and anti-inflammatory effects[1][2][3]. Moracin O is a 2-arylbenzofuran isolated from the Morus alba Linn. . Moracin O exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin O reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin O has neuroprotective and anti-inflammatory effects[1][2][3]. Moracin O is a 2-arylbenzofuran isolated from the Morus alba Linn. . Moracin O exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin O reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin O has neuroprotective and anti-inflammatory effects[1][2][3].
Moracin P
Moracin P is a 2-arylbenzofuran isolated from the Mori Cortex Radicis. Moracin P exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin P reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin P has neuroprotective and anti-inflammatory effects[1][2][3]. Moracin P is a 2-arylbenzofuran isolated from the Mori Cortex Radicis. Moracin P exhibits potent in vitro inhibitory activity against hypoxia-inducible factor (HIF-1). Moracin P reduces oxygen-glucose deprivation (OGD)-induced reactive oxygen species (ROS) production. Moracin P has neuroprotective and anti-inflammatory effects[1][2][3].
1,5-Bis(4-hydroxy-3-methoxyphenyl)-1,4-pentadien-3-one
W-Hydroxymoracin N
ethyl 5-amino-6-nitro-7-phenyl-2,3-dihydro-1H-indene-4-carboxylate
4-((6,7-DIMETHOXYQUINOLIN-4-YL)OXY)-2-METHOXYANILINE
4-CHLORO-2-METHOXY-5-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-BENZOIC ACID METHYL ESTER
5,12-dihydro-2-methylquino[2,3-b]acridine-7,14-dione
7,7-dimethyl-3-[(3-nitrophenyl)methyl]-6,8-dihydro-1H-quinoline-2,5-dione
ETHYL 3-(ISOPROPYLTHIO)-6,6-DIMETHYL-4-OXO-4,5,6,7- TETRAHYDROBENZO[C]THIOPHENE-1-CAR
2-[(2-nitrophenyl)diazenyl]-3-oxo-N-phenylbutanamide
(-)-2,3-bis[(2R,5R)-2,5-dimethylphospholanyl]maleic anhydride
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-2-(((benzyloxy)carbonyl)amino)acetic acid
Ethyl 2-amino-7-isopropyl-5-oxo-5H-[1]-benzopyrano[2,3-b]pyridine-3-carboxylate
(S)-tert-Butyl 3-(2-fluoro-6-nitrophenoxy)pyrrolidine-1-carboxylate
Etomoxir
D007004 - Hypoglycemic Agents D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor Etomoxir ((R)-(+)-Etomoxir) is an irreversible inhibitor of carnitine palmitoyltransferase 1a (CPT-1a), inhibits fatty acid oxidation (FAO) through CPT-1a and inhibits palmitate β-oxidation in human, rat and guinea pig.
Ethyl 4-[(4-nitrophenyl)amino]-1H-pyrrolo[2,3-b]pyridine-2-carbox ylate
3-(1,3-benzodioxol-5-ylmethyl)-7,7-dimethyl-6,8-dihydrochromene-2,5-dione
Butanamide,2-[2-(4-nitrophenyl)diazenyl]-3-oxo-N-phenyl-
1H-Thieno[2,3-d]imidazole-5-carboxylic acid,1-cyclohexyl-2-phenyl-
3H-Thieno[2,3-d]imidazole-5-carboxylic acid,3-cyclohexyl-2-phenyl-
ethyl 6-amino-5-cyano-4-(2,3-dihydro-1-benzofuran-5-yl)-2-methyl-4h-pyran-3-carboxylate
N-[4-(3-oxo-4-Morpholinyl)phenyl]carbaMic acid phenylMethyl ester
2-(4-Chloro-5-(cyclopropylmethoxy)-2-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
3-[1-(2,3-DIMETHOXY-PHENYL)-2-NITRO-ETHYL]-1H-INDOLE
Polyacrylamide, kationisch mit Kationenstrke <=15 und einem Restmonomergehalt <0,1
6-ACETHYOXY-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-ONE
Trimethoprim Hydrochloride
C471 - Enzyme Inhibitor > C2153 - Dihydrofolate Reductase Inhibitor
trans-p-Coumaroyl beta-D-glucopyranoside
Trans-p-coumaroyl beta-d-glucopyranoside, also known as 1-O-(4-hydroxycinnamoyl)-beta-D-glucose or 1-O-(4-coumaroyl)-β-D-glucoside, is a member of the class of compounds known as hydroxycinnamic acid glycosides. Hydroxycinnamic acid glycosides are glycosylated hydoxycinnamic acids derivatives. Trans-p-coumaroyl beta-d-glucopyranoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-p-coumaroyl beta-d-glucopyranoside can be found in tea, which makes trans-p-coumaroyl beta-d-glucopyranoside a potential biomarker for the consumption of this food product.
Ethyl-8-azido-5,6-dihydro-5-methyl-6-oxo-4H-imidazo-1,4-benzodiazepine-3-carboxylate
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D000345 - Affinity Labels Ro15-4513, imidazobenzodiazepinone derivative, is a partial inverse agonist of benzodiazepine receptor (BZR)[1]. Ro15-4513 is a potent ethanol antagonist[2]. Ro15-4513 has anti-anxiety effect[3]. Ro15-4513 is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. Strain-promoted alkyne-azide cycloaddition (SPAAC) can also occur with molecules containing DBCO or BCN groups.
6-[(3,4,5-Trihydroxy-6-methyloxan-2-yl)oxymethyl]oxane-2,3,4,5-tetrol
1-ethyl-N-(2-fluorophenyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
2-O-(6-deoxy-alpha-L-galactopyranosyl)-D-galactopyranose
N-(4-fluorophenyl)-2-(5-methoxy-1-oxo-2-isoquinolinyl)acetamide
6-O-(trans-4-coumaroyl)-beta-D-glucopyranose
An O-acyl carbohydrate that is beta-D-glucose bearing a trans-4-coumaroyl substituent at position 6.
trans-p-Coumaric acid 4-glucoside
Trans-p-coumaric acid 4-glucoside, also known as 4-O-beta-D-glucosyl-4-coumaric acid or 4-O-beta-D-glucosyl-4-hydroxycinnamate, is a member of the class of compounds known as phenolic glycosides. Phenolic glycosides are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Trans-p-coumaric acid 4-glucoside is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Trans-p-coumaric acid 4-glucoside can be found in loquat, which makes trans-p-coumaric acid 4-glucoside a potential biomarker for the consumption of this food product. trans-p-Coumaric acid 4-glucoside is found in blackcurrant. trans-p-Coumaric acid 4-glucoside is a constituent of Brassica species and other plant species.
trans-p-Coumaroyl beta-D-glucopyranoside
Trans-p-coumaroyl beta-d-glucopyranoside, also known as 1-O-(4-hydroxycinnamoyl)-beta-D-glucose or 1-O-(4-coumaroyl)-β-D-glucoside, is a member of the class of compounds known as hydroxycinnamic acid glycosides. Hydroxycinnamic acid glycosides are glycosylated hydoxycinnamic acids derivatives. Trans-p-coumaroyl beta-d-glucopyranoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-p-coumaroyl beta-d-glucopyranoside can be found in tea, which makes trans-p-coumaroyl beta-d-glucopyranoside a potential biomarker for the consumption of this food product.
2-(1,3-Benzodioxole-5-yl)-3-methyl-5-(1,2-dihydroxypropyl)benzofuran
3-(4-chloro-1H-indol-2-yl)-1-isopropyl-pyrazolo[3,4-d]pyrimidin-4-amine
2-Amino-4-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]pentanedioic acid
4-O-(beta-D-Galactopyranosyl)-alpha-L-rhamnopyranose
2-Amino-4-[3-(2-amino-2-carboxyethyl)-6-oxocyclohexa-1,4-dien-1-yl]pentanedioic acid
(1E,4E)-1,5-Bis(4-hydroxy-3-methoxyphenyl)penta-1,4-dien-3-one
4-[2-[(1-Carboxy-4-hydroxybutyl)amino]ethenyl]-2,3-dihydropyridine-2,6-dicarboxylic acid
5-[(Z)-[5-[(E)-[5-[(Z)-pyrrol-2-ylidenemethyl]pyrrol-2-ylidene]methyl]pyrrol-2-ylidene]methyl]-1H-pyrrole-2-carbaldehyde
(2R,3R,4S,5R)-2-(Hydroxymethyl)-6-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxane-3,4,5-triol
(3E)-3-[(3,4-dimethoxyphenyl)methylidene]-7-methoxychromen-4-one
2-(3-Methoxyphenyl)-3,5,6,7,8,9-hexahydrocyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one
4-[[5-Methyl-2-[3-(trifluoromethyl)phenyl]-4-oxazolyl]methyl]morpholine
beta-D-Glucopyranose, 1-O-[(2E)-3-(2-hydroxyphenyl)-1-oxo-2-propen-1-yl]-
2-(1,3-Benzoxazol-2-ylthio)-1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)ethanone
alpha-L-rhamnopyranosyl-(1->2)-alpha-D-galactopyranose
2-(2-Furanyl)-3-(4-methylphenyl)imidazo[4,5-b]quinoxaline
6-(4-hydroxy-3-methoxyphenyl)-8-methoxy-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
2-Amino-1-(4-methylphenyl)-6-oxo-4-phenylpyridine-3,5-dicarbonitrile
N-(1,3-benzodioxol-5-yl)-3-[(2-methyl-1-oxopropyl)amino]benzamide
3-(2-methoxyphenyl)-2-methyl-4-oxo-1H-quinazoline-2-carboxylic acid methyl ester
6-O-(trans-4-coumaroyl)-alpha-D-glucopyranose
An O-acyl carbohydrate that is alpha-D-glucose bearing a trans-4-coumaroyl substituent at position 6.
N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-thiophenecarboxamide
4-[[(2,3-dihydro-1H-inden-1-ylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester
(2Z)-N-(3-chlorophenyl)-2-(1,3,3-trimethylindol-2-ylidene)acetamide
3-O-(cis-4-coumaroyl)-beta-D-glucopyranose
An O-acyl carbohydrate that is beta-D-glucose bearing a cis-4-coumaroyl substituent at position 3.
3-O-(trans-4-coumaroyl)-beta-D-glucopyranose
An O-acyl carbohydrate that is beta-D-glucose bearing a trans-4-coumaroyl substituent at position 4.
2-[3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethanesulfonic acid
[3)-alpha-L-Araf-(1->3)-6d-alpha-L-gulo-Hepp-(1->]n
3,4,5-Trihydroxy-6-[(3-phenyloxiran-2-yl)methoxy]oxane-2-carboxylic acid
1-[(Z)-but-2-en-2-yl]-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one
(1S,4R,7S,8S,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.01,11.04,8]tetradecane-2,6,13-trione
(1-Acetyloxy-3-phosphonooxypropan-2-yl) heptanoate
(1-Butanoyloxy-3-phosphonooxypropan-2-yl) pentanoate
(1-Phosphonooxy-3-propanoyloxypropan-2-yl) hexanoate
7-((E-3,7-Dimethyl-7-hydroxy-4-oxo-5-YN-2-octenyl)oxy)-2H-1-benzopyran-2-one
Neohesperidose
Alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranose is a disaccharide consisting of alpha-L-rhamnose and beta-D-glucose linked via a 1->2 glycosidic bond. It has a role as a metabolite. 2-O-alpha-L-Rhamnopyranosyl-D-glucopyranose is a natural product found in Trypanosoma brucei with data available. A disaccharide consisting of alpha-L-rhamnose and beta-D-glucose linked via a 1->2 glycosidic bond.
(3S,6S)-3,6-bis(4-hydroxybenzyl)piperazine-2,5-dione
6-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranose
Ethyl 2-(6-(4-chlorophenoxy)hexyl)oxirane-2-carboxylate
D007004 - Hypoglycemic Agents D004791 - Enzyme Inhibitors
alpha-L-Fucp-(1->3)-Glcp
A disaccharide that is D-glycopyranose in which the hydroxy group at position 3 has been converted into the corresponding alpha-L-fucoside.
alpha-L-Fucp-(1->6)-beta-D-Galp
An alpha-L-Fucp-(1->6)-D-Galp in which the carbon bearing the anomeric hydroxy group has beta configuration.
alpha-L-Fucp-(1->3)-alpha-D-Glcp
An alpha-L-Fucp-(1->3)-Glcp in which the carbon bearing the anomeric hydroxy group has alpha configuration.
alpha-L-Fucp-(1->2)-beta-D-Glcp
An alpha-L-Fucp-(1->2)-D-Glcp in which the carbon bearing the anomeric hydroxy group has beta configuration.
alpha-L-Fucp-(1->2)-alpha-D-Glcp
An alpha-L-Fucp-(1->2)-D-Glcp in which the carbon bearing the anomeric hydroxy group has alpha configuration.
cyclo(L-tyrosyl-L-tyrosyl)
A cyclo(tyrosyl-tyrosyl) in which both stereocentres have L-configuration. Synthesized by Mycobacterium tuberculosis.
alpha-L-Fucp-(1->2)-D-Glcp
A disaccharide that is D-glucopyranose in which the hydroxy group at position 2 has been converted into the corresponding alpha-L-fucopyranoside.
4-O-beta-D-glucosyl-trans-4-coumaric acid
A 4-O-beta-D-glucosyl-4-coumaric acid in which the double bond has trans-configuration.
6,7-Dimethyl-8-(1-D-ribityl)lumazine
The pteridine that is lumazine substituted with methyl groups at C-6 and -7 and with a 1-D-ribityl group on N-8.
MT 63-78
MT 63-78 is a specific and potent direct AMPK activator with an EC50 of 25 μM. MT 63–78 also induces cell mitotic arrest and apoptosis. MT 63-78 blocks prostate cancer growth by inhibiting the lipogenesis and mTORC1 pathways. MT 63-78 has antitumor effects[1]. MT 63-78 is a specific and potent direct AMPK activator with an EC50 of 25 μM. MT 63–78 also induces cell mitotic arrest and apoptosis. MT 63-78 blocks prostate cancer growth by inhibiting the lipogenesis and mTORC1 pathways. MT 63-78 has antitumor effects[1].
(2r,3r,4r,5s,6s)-6-methyl-4-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2,3,5-triol
n-{2-[(11r)-8-hydroxy-13-oxo-12,15-dioxa-4-azatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁴]hexadeca-1(16),2,4,6,8,10(14)-hexaen-11-yl]ethyl}guanidine
7-({3-[(4-methylidene-5-oxooxolan-2-yl)methyl]but-2-en-1-yl}oxy)chromen-2-one
(1r,3r,5s,8s,9s,12s,13r,14r)-14-(1,2-dihydroxypropan-2-yl)-1-hydroxy-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1⁹,¹².0³,⁵.0⁵,¹³]tetradecane-6,11-dione
(1s,4s,8s,9r,11r)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione
1,5,6-trihydroxy-2-isopropyl-7,8-dimethylphenanthrene-3,4-dione
7-{[(2e)-3-[(4-methyl-5-oxo-2h-furan-2-yl)methyl]but-2-en-1-yl]oxy}chromen-2-one
n-(2-{8-hydroxy-13-oxo-12,15-dioxa-4-azatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁴]hexadeca-1(16),2,4,6,8,10(14)-hexaen-11-yl}ethyl)guanidine
3-methoxy-4-[(2s,3r)-3-methyl-7-(prop-1-yn-1-yl)-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,2-diol
(3s,6s)-3,6-bis[(4-hydroxyphenyl)methyl]-3,6-dihydropyrazine-2,5-diol
(4s,5s,5as,9as)-4-chloro-6,6,9a-trimethyl-3-oxo-1h,4h,5h,5ah,7h,8h,9h-naphtho[1,2-c]furan-5-yl acetate
(4s,6r)-6,7-dihydroxy-4,5,5,9-tetramethyltetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-1,7,9,12(15)-tetraene-11,13,14-trione
7-{[(2e)-3-{[(2r)-4-methylidene-5-oxooxolan-2-yl]methyl}but-2-en-1-yl]oxy}chromen-2-one
[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate
5-hydroxy-2-(2-hydroxy-6-methoxyphenyl)-6,7,8-trimethylchromen-4-one
(4z)-4-{2-[(1-carboxy-4-hydroxybutyl)imino]ethylidene}-2,3-dihydro-1h-pyridine-2,6-dicarboxylic acid
7-{[(2e)-3-{[(2r)-4-methyl-5-oxo-2h-furan-2-yl]methyl}but-2-en-1-yl]oxy}chromen-2-one
(1s,2r,3s,4s,5r,6s)-2,3,4,5,6-pentahydroxycyclohexyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
5-[(11r)-11-hydroxy-12,12-dimethyl-4,13-dioxatricyclo[7.4.0.0³,⁷]trideca-1(9),2,5,7-tetraen-5-yl]benzene-1,3-diol
4-hydroxy-6,7-dimethyl-8-(2,3,4,5-tetrahydroxypentyl)pteridin-2-one
10-hydroxy-12-(3-hydroxypropyl)-10-methyl-14-oxatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,11(15),12-pentaene-5,16-dione
5-hydroxy-2-methoxy-6-methyl-4-oxooxan-3-yl 2,4-dihydroxy-6-methylbenzoate
2,5-dimethoxy-4-hydroxy-[2'',3'':7,8]-furano-flavan
{"Ingredient_id": "HBIN004639","Ingredient_name": "2,5-dimethoxy-4-hydroxy-[2'',3'':7,8]-furano-flavan","Alias": "NA","Ingredient_formula": "C19H18O5","Ingredient_Smile": "COC1=C2C(CC(OC2=C3C=COC3=C1)(C4=CC=CC=C4)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6241","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-oxoneomajucin
{"Ingredient_id": "HBIN006286","Ingredient_name": "2-oxoneomajucin","Alias": "NA","Ingredient_formula": "C15H18O8","Ingredient_Smile": "CC1C(=O)CC2(C13CC(C4(C2(COC4=O)C)O)OC(=O)C3O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16384","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,6-di(4-hydroxy) benzyl-2,5-dioxopiperazine
{"Ingredient_id": "HBIN007707","Ingredient_name": "3,6-di(4-hydroxy) benzyl-2,5-dioxopiperazine","Alias": "3,6-di(4-hydroxy)benzyl-2,5-dioxopiperazine","Ingredient_formula": "C18H18N2O4","Ingredient_Smile": "C1=CC(=CC=C1CC2C(=O)NC(C(=O)N2)CC3=CC=C(C=C3)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15102","TCMID_id": "5769","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-methoxy-4-[(2s,3r)-3-methyl-7-(1-propynyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-1,2-ben-zenediol
{"Ingredient_id": "HBIN008789","Ingredient_name": "3-methoxy-4-[(2s,3r)-3-methyl-7-(1-propynyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-1,2-ben-zenediol","Alias": "NA","Ingredient_formula": "C19H18O5","Ingredient_Smile": "CC#CC1=CC2=C(C=C1)OC(C(O2)C3=C(C(=C(C=C3)O)O)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14028","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-O-β-D-glucopyranosyl-(Z)-p-coumaricacid
{"Ingredient_id": "HBIN010752","Ingredient_name": "4-O-\u03b2-D-glucopyranosyl-(Z)-p-coumaricacid","Alias": "NA","Ingredient_formula": "C15H18O8","Ingredient_Smile": "C1=CC(=CC=C1C=CC(=O)O)OC2C(C(C(C(O2)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37398","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-o-(-l-fucopyranosyl-myo-inositol
{"Ingredient_id": "HBIN010773","Ingredient_name": "4-o-(-l-fucopyranosyl-myo-inositol","Alias": "NA","Ingredient_formula": "C12H22O10","Ingredient_Smile": "NA","Ingredient_weight": "326.3","OB_score": "NA","CAS_id": "99044-50-5","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7765","PubChem_id": "NA","DrugBank_id": "NA"}
6-O-p-coumaroyl-D-glucopyranose
{"Ingredient_id": "HBIN012708","Ingredient_name": "6-O-p-coumaroyl-D-glucopyranose","Alias": "NA","Ingredient_formula": "C15H18O8","Ingredient_Smile": "C1=CC(=CC=C1C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36110","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,12-dihydroxy-20-nor-1,5(10),6,8,12-abietapentaene-3,11,14-trione
{"Ingredient_id": "HBIN012868","Ingredient_name": "7,12-dihydroxy-20-nor-1,5(10),6,8,12-abietapentaene-3,11,14-trione","Alias": "NA","Ingredient_formula": "C19H18O5","Ingredient_Smile": "NA","Ingredient_weight": "326.348","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7495","PubChem_id": "NA","DrugBank_id": "NA"}
ailanthoidol
{"Ingredient_id": "HBIN014941","Ingredient_name": "ailanthoidol","Alias": "NA","Ingredient_formula": "C19H18O5","Ingredient_Smile": "COC1=CC(=CC2=C1OC(=C2)C3=CC(=C(C=C3)O)OC)C=CCO","Ingredient_weight": "326.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "776","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5316929","DrugBank_id": "NA"}
anticancer benzofuran pmv70p691-64
{"Ingredient_id": "HBIN016313","Ingredient_name": "anticancer benzofuran pmv70p691-64","Alias": "NA","Ingredient_formula": "C19H18O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1388","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
