Exact Mass: 326.0856
Exact Mass Matches: 326.0856
Found 500 metabolites which its exact mass value is equals to given mass value 326.0856,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
cis-Melilotoside
cis-Melilotoside, also known as cis-beta-D-glucosyl-2-hydroxycinnamate or cis-coumarinic acid-beta-D-glucoside, belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans and flavonoids. cis-Melilotoside is an extremely weak basic (essentially neutral) compound (based on its pKa) and is a beta-D-glucoside consisting of cis-2-coumaric acid having a beta-D-glucosyl residue attached to the phenolic hydroxy group. cis-Melilotoside has been detected, but not quantified in, several different foods, such as globe artichokes, mentha (mint), Malabar spinach, plains prickly pears, and winter savouries. This could make cis-melilotoside a potential biomarker for the consumption of these foods. Cis-beta-d-glucosyl-2-hydroxycinnamate, also known as beta-D-glucosyl-2-coumarinic acid or cis-coumarinic acid-beta-D-glucoside, 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. Cis-beta-d-glucosyl-2-hydroxycinnamate is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Cis-beta-d-glucosyl-2-hydroxycinnamate can be found in a number of food items such as banana, black-eyed pea, common hazelnut, and cherimoya, which makes cis-beta-d-glucosyl-2-hydroxycinnamate a potential biomarker for the consumption of these food products. 2-(beta-D-glucosyloxy)-cis-cinnamic acid is a beta-D-glucoside consisting of cis-2-coumaric acid having a beta-D-glucosyl residue attached to the phenolic hydroxy group. It is functionally related to a cis-2-coumaric acid. It is a conjugate acid of a 2-(beta-D-glucosyloxy)-cis-cinnamate. cis-coumarinic acid-beta-D-glucoside is a natural product found in Dendrobium and Homo sapiens with data available.
Melilotoside
Melilotoside, also known as trans-beta-D-glucosyl-2-hydroxycinnamic acid or beta-D-glucosyl-2-coumarate, belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans and flavonoids. Melilotoside is an extremely weak basic (essentially neutral) compound (based on its pKa). Melilotoside is found in herbs and spices. Melilotoside has been isolated from Melilotus alba (white melilot), Melilotus altissimus (tall yellow sweet clover), and other plants. Trans-beta-D-glucosyl-2-hydroxycinnamic acid is a glucosyl hydroxycinnamic acid. It is a conjugate acid of a trans-beta-D-glucosyl-2-hydroxycinnamate. Melilotoside is a natural product found in Mikania laevigata, Serpocaulon triseriale, and other organisms with data available.
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].
4-O-beta-Glucopyranosyl-cis-coumaric acid
4-O-beta-D-glucosyl-cis-p-coumaric acid is a 4-O-beta-D-glucosyl-4-coumaric acid. It is a conjugate acid of a 4-O-beta-D-glucosyl-cis-p-coumarate. 4-O-beta-D-glucosyl-cis-p-coumaric acid is a natural product found in Kunzea ambigua, Breynia rostrata, and other organisms with data available.
TRIPHENYL PHOSPHATE
CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9628; ORIGINAL_PRECURSOR_SCAN_NO 9627 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9676; ORIGINAL_PRECURSOR_SCAN_NO 9675 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9722; ORIGINAL_PRECURSOR_SCAN_NO 9720 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9722; ORIGINAL_PRECURSOR_SCAN_NO 9721 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9686; ORIGINAL_PRECURSOR_SCAN_NO 9683 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9737; ORIGINAL_PRECURSOR_SCAN_NO 9735 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3638 CONFIDENCE standard compound; INTERNAL_ID 2464 CONFIDENCE standard compound; INTERNAL_ID 8249 CONFIDENCE standard compound; INTERNAL_ID 8795 CONFIDENCE standard compound; INTERNAL_ID 4175
Bilobalide A
Bilobalide A is found in fats and oils. Bilobalide A is a constituent of leaves of Ginkgo biloba (ginkgo). Constituent of leaves of Ginkgo biloba (ginkgo). Bilobalide A is found in ginkgo nuts and fats and oils. Bilobalide, a sesquiterpene trilactone constituent of Ginkgo biloba, inhibits the NMDA-induced efflux of choline with an IC50 value of 2.3 μM. Bilobalide prevents apoptosis through activation of the PI3K/Akt pathway in SH-SY5Y cells. Exerts protective and trophic effects on neurons[1][2]. Bilobalide, a sesquiterpene trilactone constituent of Ginkgo biloba, inhibits the NMDA-induced efflux of choline with an IC50 value of 2.3 μM. Bilobalide prevents apoptosis through activation of the PI3K/Akt pathway in SH-SY5Y cells. Exerts protective and trophic effects on neurons[1][2].
trans-p-Coumaric acid 4-glucoside
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.
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.
Dihydrosterigmatocystin
Dihydrosterigmatocystin is a mycotoxin of Aspergillus versicolo
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].
1-O-p-Coumaroyl-beta-D-glucose
Isolated from many plants, e.g. Solanum and Fragaria subspecies 1-O-p-Coumaroyl-beta-D-glucose is found in many foods, some of which are white cabbage, redcurrant, italian sweet red pepper, and potato. 1-O-p-Coumaroyl-beta-D-glucose is found in broccoli. 1-O-p-Coumaroyl-beta-D-glucose is isolated from many plants, e.g. Solanum and Fragaria species.
Aldobiouronic acid D3
Aldobiouronic acid D3 is found in cereals and cereal products. Aldobiouronic acid D3 is isolated from partial acid hydrolysates of gum chagual (Puya species) and the hemicelluloses from corn hulls and wheat bran. Isolated from partial acid hydrolysates of gum chagual (Puya subspecies) and the hemicelluloses from corn hulls and wheat bran. Aldobiouronic acid D3 is found in cereals and cereal products.
3,4,5-trihydroxy-6-[(2-phenylpropanoyl)oxy]oxane-2-carboxylic acid
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.
Fertaric acid
Fertaric acid is a the ester of tartaric acid and the phenolic acid ferulic acid, a type of polyphenol. Polyphenol are secondary plant metabolites and components of grapes, wines and beers. They contribute to the sensory characteristics of wine. Yeast can influence the polyphenolic wine composition by adsorbing them throught its cell wall during wine making. [Caridi 2004]
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.
Atroviridin
Atroviridin is found in fruits. Atroviridin is a constituent of Garcinia atroviridis (gelugor). Constituent of Garcinia atroviridis (gelugor). Atroviridin is found in fruits.
Demethoxykanugin
Demethoxykanugin is isolated from Rhus chinensis (Chinese gall). Isolated from Rhus chinensis (Chinese gall)
6-O-p-Coumaroyl-D-glucose
6-O-p-Coumaroyl-D-glucose is found in green vegetables. 6-O-p-Coumaroyl-D-glucose is isolated from various commercial rhubarbs (Rheum sp.). Isolated from various commercial rhubarbs (Rheum species). 6-O-p-Coumaroyl-D-glucose is found in green vegetables.
2-O-p-Coumaroyl-D-glucose
2-O-p-Coumaroyl-D-glucose is found in green vegetables. 2-O-p-Coumaroyl-D-glucose is isolated from various commercial rhubarbs (Rheum sp.). Isolated from various commercial rhubarbs (Rheum species). 2-O-p-Coumaroyl-D-glucose is found in green vegetables.
O-Demethylforbexanthone
O-Demethylforbexanthone is found in fruits. O-Demethylforbexanthone is a constituent of Rheedia brasiliensis (bakupari) Constituent of Rheedia brasiliensis (bakupari). O-Demethylforbexanthone is found in herbs and spices and fruits.
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
3-O-alpha-D-Glucopyranuronosyl-D-xylose
3-O-alpha-D-Glucopyranuronosyl-D-xylose is found in cereals and cereal products. 3-O-alpha-D-Glucopyranuronosyl-D-xylose is isolated from hemicellulose hydrolysates, from pear cell-wall xylan, from various wheat-straw preparations and from corn hulls. Isolated from hemicellulose hydrolysates, from pear cell-wall xylan, from various wheat-straw preparations and from corn hulls. 3-O-alpha-D-Glucopyranuronosyl-D-xylose is found in pomes, cereals and cereal products, and fats and oils.
Bilobalide
(1E,4E)-1,5-Bis(4-hydroxy-3-methoxyphenyl)penta-1,4-dien-3-one
Aspirin eugenol ester
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
Brasofensine
Glucose lactate acetate
Ethyl 8-azido-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
3-[4-Hydroxy-3-[3-(4-hydroxyphenyl)prop-2-enoyloxy]phenyl]prop-2-enoic acid
cis-o-Coumaric acid 2-glucoside
Isolated from Melilotus alba (white melilot), Melilotus altissima (tall yellow sweet clover) and other plants. trans-o-Coumaric acid 2-glucoside is found in herbs and spices and pulses. Isolated from Melilotus alba (white melilot). cis-o-Coumaric acid 2-glucoside is found in herbs and spices and pulses.
Feruloyltartaric acid
Feruloyltartaric acid, also known as trans-fertaric acid or feruloyltartarate, belongs to coumaric acids and derivatives class of compounds. Those are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. Feruloyltartaric acid is practically insoluble (in water) and a moderately acidic compound (based on its pKa). Feruloyltartaric acid can be found in common grape, grape wine, sherry, and vinegar, which makes feruloyltartaric acid a potential biomarker for the consumption of these food products.
Bilobalide
Bilobalide is a terpenoid trilactone found in extracts of Ginkgo biloba. Bilobalide is a natural product found in Ginkgo biloba with data available. See also: Ginkgo (part of). relative retention time with respect to 9-anthracene Carboxylic Acid is 0.473 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.474 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.470 Bilobalide, a sesquiterpene trilactone constituent of Ginkgo biloba, inhibits the NMDA-induced efflux of choline with an IC50 value of 2.3 μM. Bilobalide prevents apoptosis through activation of the PI3K/Akt pathway in SH-SY5Y cells. Exerts protective and trophic effects on neurons[1][2]. Bilobalide, a sesquiterpene trilactone constituent of Ginkgo biloba, inhibits the NMDA-induced efflux of choline with an IC50 value of 2.3 μM. Bilobalide prevents apoptosis through activation of the PI3K/Akt pathway in SH-SY5Y cells. Exerts protective and trophic effects on neurons[1][2].
Boeravinone A
Boeravinone A is a member of rotenones. boeravinone A is a natural product found in Boerhavia diffusa with data available.
Eucalyptin
Eucalyptin is a natural product found in Myrcia citrifolia, Myrcia glabra, and other organisms with data available.
3,5-Dimethoxy-6,7-methylenedioxyflavone
5,7-Dimethoxy-3,4-methylenedioxyflavone
7,8-Dimethoxy-3,4-methylenedioxyflavone
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
2-(Butoxymethyl)-1,3-dihydroxyanthracene-9,10-dione
3,5,7-Ttrihydroxylchromone 3-O-??-D-xylopyranoside
4-Methoxy-1,6-phenazinedicarboxylic acid dimethyl ester
2,2-Dimethyl-5,8,9-trihydroxy-2H,6H-pyrano[3,2-b]xanthen-6-one
3-O-(3,4-Dihydroxycinnamoyl),Me ester-2,3,4-Trihydroxy-2-methylbutanoic acid,
6-hydroxy-2,7,8-trimethoxy-5H-phenanthro[4,5-bcd]pyran-5-one|ochracinanthrone
1,3,5-trihydroxy-13,13-dimethyl-2H-pyran[7,6-b]xanthen-9-one
(2R,2S,4S)-gamma-Glutamylmarasmine|gamma-Glutamylmarasmine
(4S,5S,8S,9R,10S)-8,9,10-trihydroxy-4-[4-hydroxy-3-methoxyphenyl]-1,6-dioxaspiro[4,5]decan-2-one|foveospirolide
(E)-1-oxo-3,4-dihydro-1H-isochromen-7-yl 3-(3,4-dihydroxyphenyl)acrylate
2,2-Dimethyl-6,10,11-trihydroxy-2,7-dihydropyrano[3,2-c]xanthene-7-one
4-O-(p-coumaroyl)-D-glucopyranose|4-O-p-Cumaroyl-glucopyranose|4-p-Cumaroyl-glucose
7,8-dimethoxy-3,4-methylenedioxy-phenanthrene-1-carboxylic acid|demethylaristofolin C
(-)-3-O-galloylshikimic acid|(-)-shikimic acid 3-O-gallate|3-O-galloyl shikimic acid|3-O-galloyl-(-)-shikimic acid|3-O-Galloylshikimic acid|5-O-galloylshikimic acid|shikimic acid 5-O-gallate
5,7-dimethoxy-6-(3-chloro-2-hydroxy-3-methylbutyl)coumarin|5,7-Dimethoxy-6-(3-chlor-2-hydroxy-3-methyl-butyl)-cumarin|5,7-dimethoxy-6-(3-chloro-2-hydroxy-3-methylbutyl)coumarin
3-O-(alpha-D-glucopyranosyluronic acid)-D-xylose|O-alpha-D-Glucuronopyranosyl-(1->3)-D-xylopyranose
rel-(2R,3R)-2-(4-hydroxyphenyl)-4-[(E)-1-(4-hydroxyphenyl)methylidene]-5-oxotetrahydro-3-furancarboxylic acid
2-O-(3,4-Dihydroxycinnamoyl),Me ester-2,3,4-Trihydroxy-2-methylbutanoic acid,
(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
4H-1-Benzopyran-4-one, 2-(1,3-benzodioxol-5-yl)-5,7-dimethoxy-
2-(1-hydroxy-1-methylethyl)-9-methoxy-1,8-dioxa-dicyclopenta[b,g]naphthalene-4,10-dione
4-O-galloyl-(-)-shikimic acid|4-O-Galloylshikimic acid
3-Acetonyl-1,8-dihydroxy-6-methoxy-anthrachinon|3-acetonyl-1,8-dihydroxy-6-methoxy-anthraquinone|Dermoquinone
4,5-methylenedioxy-7,2-dimethoxyflavone|millettocalyxin A
(+)-6-(3-Chloro-2-hydroxy-3-methylbutyl)-5,7-dimethoxycoumarin
(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
4,5-dihydroxy-9,10-dioxo-3-propylanthracene-2-carboxylic acid
Melilotoside
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
(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
3-[5-(3,4-dihydroxy-4-methyl-5-oxooxolan-2-yl)-2-hydroxy-4-methoxyphenyl]propanoic 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_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\\%
(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\\%
Dihydrosterigmatocystin
A sterigmatocystin whose skeleton comprises a xanthone ring system ortho-fused to a dihydrofuranofuran moiety.
1-O-p-Coumaroyl-beta-D-glucose
trans-p-Coumaric acid 4-glucoside
N-(5-aminopentyl)-5-chloronaphthalene-1-sulfonamide
METHYL 3-([[3-(TRIFLUOROMETHYL)PHENYL]THIO]METHYL)BENZOATE
cis-1,2-dicyano-1,2-bis(2,4,5-trimethyl-3-thienyl)ethene
5-Chloro-1-(4-fluorophenyl)-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
3-bromo-4-(4-propan-2-ylpiperazin-1-yl)benzoic acid
3-bromo-4-[(4-ethylpiperazin-1-yl)methyl]benzoic acid
methyl 3-bromo-4-[(3-methylpiperazin-1-yl)methyl]benzoate
2-BROMO-1-[3,5-DI(TERT-BUTYL)-4-HYDROXYPHENYL]ETHAN-1-ONE
1-CYCLOPROPYL-5-AMIDO-6,7,8-TRIFLUORO-1,4-DIHYDRO-4-OXO-3- QUINOLINECARBOXYLIC ACID ETHYL ESTER
TRANS-1,2-DICYANO-1,2-BIS(2,4,5-TRIMETHYL-3-THIENYL)ETHENE
4-Boc-7-Bromo-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine
(6Z,6Z)-6,6-{1,2-Ethanediylbis[imino(Z)methylylidene]}bis(2,4-c yclohexadien-1-one) - nickel (1:1)
2-(2-Acethydrazide)-7-chloro-5-phenyl-2H-1,4-dibenzodiazopine-2-one
5-chloro-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid
4-CHLORO-2-METHOXY-5-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-BENZOIC ACID METHYL ESTER
3-[(4μ-Chloro-1-naphthyloxy)methyl]phenylboronic acid
Silane, [(5-bromo-2,3-dihydro-1H-inden-1-yl)oxy](1,1-dimethylethyl)dimethyl-
6-Chloro-9-beta-D-(2,3-isopropylidene)ribofuranosylpurine
[4-(6-acetyloxy-1-benzothiophen-2-yl)phenyl] acetate
5,12-dihydro-2-methylquino[2,3-b]acridine-7,14-dione
ETHYL 3-(ISOPROPYLTHIO)-6,6-DIMETHYL-4-OXO-4,5,6,7- TETRAHYDROBENZO[C]THIOPHENE-1-CAR
(3-((4-METHOXYBENZYL)OXY)-5-(TRIFLUOROMETHYL)PHENYL)BORONIC ACID
2-(2-Anilinovinyl)-3-(3-sulfopropyl)-2-thiazolinium inner salt
2-[(2-nitrophenyl)diazenyl]-3-oxo-N-phenylbutanamide
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-2-(((benzyloxy)carbonyl)amino)acetic acid
2-Boc-5-bromo-1,2,3,4-tetrahydroisoquinolin-8-amine
3-(2-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
3-(3-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
3-(4-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
4-CHLORO-2-[2-PHENYLVINYL]-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE
2-(4-(2-Bromoethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-(3-(2-Bromoethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-(3-Bromo-5-ethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
4-Chloro-1-{[2-(trimethylsilyl)ethoxy]methyl}-1H-pyrrolo[2,3-b]py ridine-5-carboxylic acid
4-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-quinoxaline
Ethyl 4-[(4-nitrophenyl)amino]-1H-pyrrolo[2,3-b]pyridine-2-carbox ylate
5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]pyrazole-3-carboxylic acid
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-
7-(4-methylsulfanylphenyl)-5-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
p-Nitrophenyl 2-Azido-2-deoxy-a-D-galactopyranoside
Polyacrylamide, kationisch mit Kationenstrke <=15 und einem Restmonomergehalt <0,1
Brasofensine
C78272 - Agent Affecting Nervous System > C38149 - Antiparkinsonian Agent
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.
1-ethyl-N-(2-fluorophenyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
4-[[(2-Methyl-1,3-benzothiazol-6-yl)-oxomethyl]amino]benzoic acid methyl ester
4-[(E)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione
N-(2-methoxyphenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)amino]acetamide
2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)-N-phenylacetamide
2-[(4-Chlorophenyl)methyl]-4-(prop-2-enylthio)quinazoline
5-[(4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-yl)oxymethyl]-2-furancarboxylic acid
N-(4-fluorophenyl)-2-(5-methoxy-1-oxo-2-isoquinolinyl)acetamide
5-(1,3-benzodioxol-5-yl)-3-[3-(methylthio)phenyl]-1H-imidazol-2-one
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.
3-(4-chloro-1H-indol-2-yl)-1-isopropyl-pyrazolo[3,4-d]pyrimidin-4-amine
7,9-Dimethoxy-6-phenyl-[1,3]dioxolo[4,5-g]chromen-8-one
2-Amino-4-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]pentanedioic acid
2-Amino-4-[3-(2-amino-2-carboxyethyl)-6-oxocyclohexa-1,4-dien-1-yl]pentanedioic acid
(2S,3R,4S,5R)-3,5,6-trihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid
4-[2-[(1-Carboxy-4-hydroxybutyl)amino]ethenyl]-2,3-dihydropyridine-2,6-dicarboxylic acid
[2-[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]acetyl] 2-hydroxypropaneperoxoate
3-[4-Hydroxy-3-[3-(4-hydroxyphenyl)prop-2-enoyloxy]phenyl]prop-2-enoic acid
1-(4-Methoxyphenyl)-3-[(2-oxo-3-indolyl)amino]thiourea
N-[(E)-1-(furan-2-yl)-3-(furan-2-ylmethylamino)-3-oxoprop-1-en-2-yl]furan-2-carboxamide
6-[(E)-2-(3-ethoxy-4-hydroxyphenyl)ethenyl]-4-(trifluoromethyl)pyrimidin-2(1H)-one
(2S,3S)-trans-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of trans-ferulic acid with one of the hydroxy groups of D-tartaric acid.
2-Chloro-4-(3,4-dimethoxyphenyl)-6-phenylpyrimidine
1-Methyl-4-[(4-methylphenyl)thio]-3-nitro-2-quinolinone
4-{[(E)-3-Mercapto-5-phenyl-[1,2,4]triazol-4-ylimino]-methyl}-2-methoxy-phenol
2-(3-Methoxyphenyl)-3,5,6,7,8,9-hexahydrocyclohepta[2,3]thieno[2,4-b]pyrimidin-4-one
[(5-anilino-4-phenyl-4H-1,2,4-triazol-3-yl)thio]acetic acid
N-(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-furancarboxamide
N-[(E)-1-(1,3-Benzodioxol-5-yl)ethylideneamino]-1,3-benzodioxole-5-carboxamide
beta-D-Glucopyranose, 1-O-[(2E)-3-(2-hydroxyphenyl)-1-oxo-2-propen-1-yl]-
1-(Phenylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea
2-(1,3-Benzoxazol-2-ylthio)-1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)ethanone
4-[2,3,5,6-Tetrafluoro-4-(1-propen-1-yl)phenoxy]benzoic acid
3-(4-Fluorophenyl)-6-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
4-(2,5-Dimethylfuran-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.6.0.02,6.011,15]pentadeca-1(9),2,4,11(15)-tetraen-7-one
3-[[[5-(Phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid
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.
4-methoxy-N-[1-methyl-2-oxo-6-(trifluoromethyl)-3-pyridinyl]benzamide
N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-thiophenecarboxamide
N-(1,3-benzodioxol-5-ylmethylene)-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide
4-[[(2,3-dihydro-1H-inden-1-ylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester
6-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-4-quinolinamine
1,1-Difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonic acid
(2R,3R)-cis-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of cis-ferulic acid with one of the hydroxy groups of L-tartaric acid.
(2S,3S)-cis-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of cis-ferulic acid with one of the hydroxy groups of D-tartaric acid.
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
[(E)-1-(2,4-dimethyl-1,3-oxazol-5-yl)ethylideneamino] 4-(trifluoromethyl)benzoate
(3E)-3-[[4-(Methylamino)-3-nitrophenyl]methylidene]thiochromen-4-one
6-(4-Ethenyl-2-methoxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
1-(3,4-Dihydroxyphenyl)-3-(4-methoxy-1-benzofuran-5-yl)propane-1,3-dione
2-[(2E)-2-(2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene)ethylidene]azaniumyl-4-hydroxy-4-oxobutanoate
3,4,5-Trihydroxy-6-[(3-phenyloxiran-2-yl)methoxy]oxane-2-carboxylic acid
4,5-Dihydroxy-9,10-dioxo-3-propylanthracene-2-carboxylic 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-Acetyloxy-3-phosphonooxypropan-2-yl) heptanoate
(1-Butanoyloxy-3-phosphonooxypropan-2-yl) pentanoate
(1-Phosphonooxy-3-propanoyloxypropan-2-yl) hexanoate
[(1R,12R)-6,8,11,19-tetraoxapentacyclo[10.8.0.02,10.05,9.013,18]icosa-2(10),3,5(9),13(18),14,16-hexaen-16-yl] acetate
2-[(2-Benzothiazolyl)azo]-4-(dimethylamino)benzoic acid
(2R,3R)-trans-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of trans-ferulic acid with one of the hydroxy groups of L-tartaric acid.
acetaminophen O-beta-D-glucosiduronate
A beta-D-glucosiduronate that is the conjugate base of acetaminophen O-beta-D-glucosiduronic acid, obtained by deprotonation of the carboxy group.
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.
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].
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
(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
(3r,5as,6s,10ar)-6-hydroxy-2-methyl-3,10a-bis(methylsulfanyl)-3h,5ah,6h,10h-pyrazino[1,2-a]indole-1,4-dione
(1s,2r,3r)-1,2,6,7-tetrahydroxy-3-methyl-1h,2h,3h-cyclohexa[a]fluorene-4,11-dione
6,9,11-trihydroxy-2,2-dimethyl-1,5-dioxatetraphen-10-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
15-hydroxy-11-methoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,9,11,14,16,18-hexaen-13-one
[(2r,3s,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate
methyl 8-hydroxy-9-oxo-6-(2-oxopropyl)xanthene-1-carboxylate
methyl 7-hydroxy-2-(4-methoxyphenyl)-4-oxochromene-5-carboxylate
(4z)-4-{2-[(1-carboxy-4-hydroxybutyl)imino]ethylidene}-2,3-dihydro-1h-pyridine-2,6-dicarboxylic acid
(1s,13s)-17-methoxy-5,7,11,14-tetraoxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15,17,19-hexaen-21-one
(1s,2r,3s,4s,5r,6s)-2,3,4,5,6-pentahydroxycyclohexyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
5-hydroxy-2-methoxy-6-methyl-4-oxooxan-3-yl 2,4-dihydroxy-6-methylbenzoate
1,3,5-trihydroxy-13,13-dimethyl-2h-pyran[6,7-b]-xanthen-9-one
{"Ingredient_id": "HBIN001061","Ingredient_name": "1,3,5-trihydroxy-13,13-dimethyl-2h-pyran[6,7-b]-xanthen-9-one","Alias": "NA","Ingredient_formula": "C18H14O6","Ingredient_Smile": "CC1(C=CC2=C(O1)C(=C3C(=C2)C(=O)C4=C(C=C(C=C4O3)O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21707","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',4'-methylenedi oxy-6,7-dimethoxyflavone
{"Ingredient_id": "HBIN007500","Ingredient_name": "3',4'-methylenedi oxy-6,7-dimethoxyflavone","Alias": "NA","Ingredient_formula": "C18H14O6","Ingredient_Smile": "COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC4=C(C=C3OC)OCO4","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14356","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,5,7-ttrihydroxylchromone 3-o-β-d-xylopyra-noside
{"Ingredient_id": "HBIN007586","Ingredient_name": "3,5,7-ttrihydroxylchromone 3-o-\u03b2-d-xylopyra-noside","Alias": "NA","Ingredient_formula": "C14H14O9","Ingredient_Smile": "C1C(C(C(C(O1)OC2=COC3=CC(=CC(=C3C2=O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "22055","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"}
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"}
