Exact Mass: 178.0543
Exact Mass Matches: 178.0543
Found 500 metabolites which its exact mass value is equals to given mass value 178.0543,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Coniferaldehyde
Coniferaldehyde (CAS: 458-36-6), also known as 4-hydroxy-3-methoxycinnamaldehyde or ferulaldehyde, belongs to the class of organic compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Coniferaldehyde is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, coniferaldehyde is found, on average, in the highest concentration within sherries. Coniferaldehyde has also been detected, but not quantified in, several different foods, such as highbush blueberries, lima beans, Chinese cabbages, loquats, and greenthread tea. This could make coniferaldehyde a potential biomarker for the consumption of these foods. BioTransformer predicts that coniferaldehyde is a product of caffeic aldehyde metabolism via a catechol-O-methylation-pattern2 reaction catalyzed by the enzyme catechol O-methyltransferase (PMID: 30612223). Coniferyl aldehyde, also known as 4-hydroxy-3-methoxycinnamaldehyde or 4-hm-ca, is a member of the class of compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Coniferyl aldehyde is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Coniferyl aldehyde can be found in a number of food items such as pear, common walnut, kelp, and citrus, which makes coniferyl aldehyde a potential biomarker for the consumption of these food products. Coniferyl aldehyde is a low molecular weight phenolic compound susceptible to be extracted from cork stoppers into wine . Coniferyl aldehyde is a member of the class of cinnamaldehydes that is cinnamaldehyde substituted by a hydroxy group at position 4 and a methoxy group at position 3. It has a role as an antifungal agent and a plant metabolite. It is a member of cinnamaldehydes, a phenylpropanoid and a member of guaiacols. It is functionally related to an (E)-cinnamaldehyde. 4-Hydroxy-3-methoxycinnamaldehyde is a natural product found in Pandanus utilis, Microtropis japonica, and other organisms with data available. A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by a hydroxy group at position 4 and a methoxy group at position 3. Acquisition and generation of the data is financially supported in part by CREST/JST. Coniferaldehyde (Ferulaldehyde) is an effective inducer of heme oxygenase-1 (HO-1). Coniferaldehyde exerts anti-inflammatory properties in response to LPS. Coniferaldehyde inhibits LPS-induced apoptosis through the PKCα/β II/Nrf-2/HO-1 dependent pathway in RAW264.7 macrophage cells[1]. Coniferaldehyde (Ferulaldehyde) is an effective inducer of heme oxygenase-1 (HO-1). Coniferaldehyde exerts anti-inflammatory properties in response to LPS. Coniferaldehyde inhibits LPS-induced apoptosis through the PKCα/β II/Nrf-2/HO-1 dependent pathway in RAW264.7 macrophage cells Coniferaldehyde. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=458-36-6 (retrieved 2024-09-04) (CAS RN: 458-36-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Gluconolactone
Gluconolactone, also known as glucono-delta-lactone or GDL (gluconate), belongs to the class of organic compounds known as gluconolactones. These are polyhydroxy acids (PHAs) containing a gluconolactone molecule, which is characterized by a tetrahydropyran substituted by three hydroxyl groups, one ketone group, and one hydroxymethyl group. Gluconolactone is a lactone of D-gluconic acid. Gluconolactone can be produced by enzymatic oxidation of D-glucose via the enzyme glucose oxidase. It is a fundamental metabolite found in all organisms ranging from bacteria to plants to animals. Gluconolactone has metal chelating, moisturizing and antioxidant activities. Its ability in free radicals scavenging accounts for its antioxidant properties. Gluconolactone, is also used as a food additive with the E-number E575. In foods it is used as a sequestrant, an acidifier or a curing, pickling, or leavening agent. Gluconolactone is also used as a coagulant in tofu processing. Gluconolactone is widely used as a skin exfoliant in cosmetic products, where it is noted for its mild exfoliating and hydrating properties. Pure gluconolactone is a white odorless crystalline powder. It is pH-neutral, but hydrolyses in water to gluconic acid which is acidic, adding a tangy taste to foods. Gluconic acid has roughly a third of the sourness of citric acid. One gram of gluconolactone yields roughly the same amount of metabolic energy as one gram of sugar. Food additive; uses include acidifier, pH control agent, sequestrant C26170 - Protective Agent > C275 - Antioxidant D-(+)-Glucono-1,5-lactone is a polyhydroxy (PHA) that is capable of metal chelating, moisturizing and antioxidant activity.
L-Gulonolactone
L-Gulonolactone (also known as reduced ascorbic acid, RAA) is the substrate of the enzyme L-gulono-1,4-lactone oxidoreductase (EC 1.1.3.8), which catalyzes the last step of the biosynthesis of L-ascorbic acid (vitamin C) in plants and animals. The enzyme L-Gulono-1,4-lactone oxidase is missing in scurvy-prone, vitamin C-deficient animals, such as humans. L-Gulonolactone is present in human blood and has been used as one of the markers to compare changes in exercise-induced oxidative stress. (PMID: 16956367, 16494601) [HMDB] L-Gulonolactone (also known as reduced ascorbic acid, RAA) is the substrate of the enzyme L-gulono-1,4-lactone oxidoreductase (EC 1.1.3.8), which catalyzes the last step of the biosynthesis of L-ascorbic acid (vitamin C) in plants and animals. The enzyme L-Gulono-1,4-lactone oxidase is missing in scurvy-prone, vitamin C-deficient animals, such as humans. L-Gulonolactone is present in human blood and has been used as one of the markers to compare changes in exercise-induced oxidative stress. (PMID:16956367, 16494601). COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS L-Gulono-1,4-lactone is a substrate of L-gulono-1,4-lactone oxidoreductase, which catalyzes the last step of the biosynthesis of L-ascorbic (Vatamin) C. In other words, L-Gulono-1,4-lactone is a direct precursor of vitamin C in animals, in plants and in some protists.
3-Keto-b-D-galactose
3-Keto-b-D-galactose is an intermediate in Galactose metabolism, N-Glycan degradation, Glycosaminoglycan degradation, glycerolipid metabolism, Sphingolipid metabolism, Glycosphingolipid biosynthesis - ganglioseries and Glycan structures - degradation through the enzyme galactosidase, beta 1 [EC:3.2.1.23], and an intermediate of Fructose and mannose metabolism, Galactose metabolism, Ascorbate and aldarate metabolism, Bile acid biosynthesis, Glycine, serine and threonine metabolism, Lysine degradation, Bisphenol A degradation, Nucleotide sugars metabolism, Linoleic acid metabolism, Tetrachloroethene degradation, and Butanoate metabolism through th enzyme retinol dehydrogenase 13 (all-trans/9-cis) [EC:1.1.1.-] (KEGG). 3-keto-β-d-galactose, also known as 3-dehydro-β-D-galactose, is a member of the class of compounds known as hexoses. Hexoses are monosaccharides in which the sugar unit is a is a six-carbon containing moeity. 3-keto-β-d-galactose is soluble (in water) and a very weakly acidic compound (based on its pKa). 3-keto-β-d-galactose can be found in a number of food items such as pecan nut, common wheat, nopal, and grass pea, which makes 3-keto-β-d-galactose a potential biomarker for the consumption of these food products.
2-deoxy-D-gluc-5-ulosonic acid
1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene
1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene is considered to be soluble (in water) and relatively neutral
5-Deoxy glucuronic acid
D-Arabino-hexos-2-ulose
D-Arabino-hexos-2-ulose is formed during sterilisation of foods by irradiation
2-Keto-3-deoxy-D-gluconic acid
2-Keto-3-deoxy-D-gluconic acid is a substrate for Fructose-bisphosphate aldolase A. [HMDB] 2-Keto-3-deoxy-D-gluconic acid is a substrate for Fructose-bisphosphate aldolase A.
Galactonolactone
Galactonolactone has been determined in human urine by reversed-phase HPLC for the specific evaluation of metabolic by-products in the urine of galactosemic patients and based on the simultaneous determination of gluconolactone, galactonolactone and galactitol. (PMID: 1797843). Patients with galactose-1-phosphate uridyltransferase (GALT) deficiency, given a load of galactose have been shown to excrete six times as much galactonate in their urine as normal subjects exposed to the same experimental conditions. The production of galactonate occurs through the activity of a soluble NAD+-dependent galactose dehydrogenase, catalyzing the conversion of galactose to D-galactonolactone (D-galactose: NAD+ oxidoreductase, EC 1.1.1.48). (OMMBID). Galactonolactone has been determined in human urine by reversed-phase HPLC for the specific evaluation of metabolic by-products in the urine of galactosemic patients and based on the simultaneous determination of gluconolactone, galactonolactone and galactitol. (PMID: 1797843)
(3R,4R,5R)-5-(1,2-dihydroxyethyl)-3,4-dihydroxyoxolan-2-one
D-Gulono-1,4-lactone
Acquisition and generation of the data is financially supported in part by CREST/JST. 1,4-D-Gulonolactone is an endogenous metabolite.
L-galactono-1,4-lactone
L-galactono-1,4-lactone, also known as L-galactonate-γ-lactone, is a member of the class of compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. L-galactono-1,4-lactone is soluble (in water) and a very weakly acidic compound (based on its pKa). L-galactono-1,4-lactone can be found in a number of food items such as abalone, pear, black-eyed pea, and borage, which makes L-galactono-1,4-lactone a potential biomarker for the consumption of these food products. L-galactono-1,4-lactone may be a unique S.cerevisiae (yeast) metabolite.
AI3-11206
(E)-2-methoxycinnamic acid is a member of the class of cinnamic acids that is trans-cinnamic acid carrying a methoxy substituent at position 2 on the benzene ring. It has a role as a Brassica napus metabolite and an EC 1.14.18.1 (tyrosinase) inhibitor. It is a member of cinnamic acids and a monomethoxybenzene. It is functionally related to a trans-cinnamic acid. See also: Cinnamomum cassia twig (part of). A member of the class of cinnamic acids that is trans-cinnamic acid carrying a methoxy substituent at position 2 on the benzene ring. 2-Methoxycinnamic acid is a noncompetitive inhibitor of tyrosinase[1]. 2-Methoxycinnamic acid is a noncompetitive inhibitor of tyrosinase[1].
4-Methoxycinnamic acid
4-Methoxycinnamic acid, also known as para-methoxycinnamate or O-methyl-p-coumarate, belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid. Outside of the human body, 4-Methoxycinnamic acid is found, on average, in the highest concentration within turmerics. 4-Methoxycinnamic acid has also been detected, but not quantified in cow milk and wild celeries. This could make 4-methoxycinnamic acid a potential biomarker for the consumption of these foods. 4-methoxycinnamic acid is a methoxycinnamic acid having a single methoxy substituent at the 4-position on the phenyl ring. It is functionally related to a cinnamic acid. 4-Methoxycinnamic acid is a natural product found in Balanophora tobiracola, Murraya euchrestifolia, and other organisms with data available. Esters of p-methoxycinnamic acid are among the popular UV-B screening compounds used in various cosmetic formulations in sunscreen products. trans-p-Methoxycinnamic acid is found in wild celery and turmeric. (E)-3-(4-Methoxyphenyl)acrylic acid (compound 3) is isolated from Arachis hypogaea, Scrophularia buergeriana Miquel, Aquilegia vulgaris, Anigozanthos preissii and so on. (E)-3-(4-Methoxyphenyl)acrylic acid shows significant hepatoprotective activity, anti-amnesic, cognition-enhancing activity, antihyperglycemic, and neuroprotective activities[1]. (E)-3-(4-Methoxyphenyl)acrylic acid (compound 3) is isolated from Arachis hypogaea, Scrophularia buergeriana Miquel, Aquilegia vulgaris, Anigozanthos preissii and so on. (E)-3-(4-Methoxyphenyl)acrylic acid shows significant hepatoprotective activity, anti-amnesic, cognition-enhancing activity, antihyperglycemic, and neuroprotective activities[1]. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii.
(S)-Isosclerone
(S)-Isosclerone is found in nuts. (S)-Isosclerone is a constituent of Juglans regia (walnut). Constituent of Juglans regia (walnut). (S)-Isosclerone is found in nuts.
3-(4-Hydroxy-2-methoxyphenyl)-2-propenal
3-(4-Hydroxy-2-methoxyphenyl)-2-propenal is found in fats and oils. 3-(4-Hydroxy-2-methoxyphenyl)-2-propenal is a constituent of sunflower and vanilla. Constituent of sunflower and vanilla. 3-(4-Hydroxy-2-methoxyphenyl)-2-propenal is found in fats and oils and herbs and spices.
(Z)-10-Hydroxy-8-decene-4,6-diynoic acid
(Z)-10-Hydroxy-8-decene-4,6-diynoic acid is found in mushrooms. (Z)-10-Hydroxy-8-decene-4,6-diynoic acid is a constituent of Fistulina hepatica (beefsteak fungus)
Methylthiomethyl 2-methylbutanethiolate
Methylthiomethyl 2-methylbutanethiolate is found in alcoholic beverages. Methylthiomethyl 2-methylbutanethiolate is isolated from hop oi
3-(4-Methylphenyl)oxiranecarboxylic acid
Esters used in perfumery and flavourin
Di-alpha-furfuryl ether
Di-alpha-furfuryl ether is a flavouring ingredient. Flavouring ingredient
(E)-10-Hydroxy-2-decene-4,6-diynoic acid
(E)-10-Hydroxy-2-decene-4,6-diynoic acid is found in mushrooms. (E)-10-Hydroxy-2-decene-4,6-diynoic acid is a food lipid.
Ethyl Phenylglyoxylate
Ethyl Phenylglyoxylate, also known as Ethyl 2-oxo-2-phenylacetate or Ethyl benzoylformate, is classified as a benzoyl derivative or a Benzoyl derivative derivative. Benzoyl derivatives are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-). Ethyl Phenylglyoxylate is considered to be practically insoluble (in water) and basic
(Z)-p-Methoxycinnamic acid
4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii.
(3R,4R,5S,6R)-3,4,5,6-Tetrahydroxyoxepan-2-one
Mellein
Mellein, also known as (R)-mellein, is a member of the class of compounds known as 2-benzopyrans. 2-benzopyrans are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 2-position. Mellein is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Mellein can be found in cocoa powder, which makes mellein a potential biomarker for the consumption of this food product. Mellein is a dihydroisocoumarin, a phenolic compound produced by Aspergillus ochraceus .
Methyl p-coumarate
Methyl p-coumarate, also known as 4-coumaric acid methyl ester, is a member of the class of compounds known as coumaric acid esters. Coumaric acid esters are aromatic compounds containing an ester derivative of coumaric acid. Methyl p-coumarate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Methyl p-coumarate can be found in bamboo shoots and garden onion, which makes methyl p-coumarate a potential biomarker for the consumption of these food products. Methyl p-coumarate (Methyl 4-hydroxycinnamate), an esterified derivative of p-Coumaric acid (pCA), is isolated from the flower of Trixis michuacana var longifolia. Methyl p-coumarate could inhibit the melanin formation in B16 mouse melanoma cells. Methyl p-coumarate also has strong in vitro inhibitory effect on A. alternata and other pathogens[1][2]. Methyl p-coumarate (Methyl 4-hydroxycinnamate), an esterified derivative of p-Coumaric acid (pCA), is isolated from the flower of Trixis michuacana var longifolia. Methyl p-coumarate could inhibit the melanin formation in B16 mouse melanoma cells. Methyl p-coumarate also has strong in vitro inhibitory effect on A. alternata and other pathogens[1][2].
trans-2-Methoxycinnamic acid
Trans-2-methoxycinnamic acid is a member of the class of compounds known as coumaric acids. Coumaric acids are aromatic compounds containing a cinnamic acid moiety hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. Trans-2-methoxycinnamic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Trans-2-methoxycinnamic acid can be found in chinese cinnamon, which makes trans-2-methoxycinnamic acid a potential biomarker for the consumption of this food product. 2-Methoxycinnamic acid is a noncompetitive inhibitor of tyrosinase[1]. 2-Methoxycinnamic acid is a noncompetitive inhibitor of tyrosinase[1].
pCAME
4-coumaric acid methyl ester is a cinnamate ester that is the methyl ester of 4-coumaric acid. It has a role as a melanin synthesis inhibitor, a fungal metabolite, an anti-inflammatory agent, an antifungal agent and a plant metabolite. It is a cinnamate ester, a member of phenols and a methyl ester. It is functionally related to a 4-coumaric acid. Methyl 4-hydroxycinnamate is a natural product found in Alpinia blepharocalyx, Grevillea robusta, and other organisms with data available. (E)-Methyl 4-coumarate (Methyl 4-hydroxycinnamate), found in several plants, such as Allium cepa or Morinda citrifolia L. leaves. (E)-Methyl 4-coumarate cooperates with Carnosic Acid in inducing apoptosis and killing acute myeloid leukemia cells, but not normal peripheral blood mononuclear cells. Antioxidant and antimicrobial activity. (E)-Methyl 4-coumarate (Methyl 4-hydroxycinnamate), found in several plants, such as Allium cepa or Morinda citrifolia L. leaves. (E)-Methyl 4-coumarate cooperates with Carnosic Acid in inducing apoptosis and killing acute myeloid leukemia cells, but not normal peripheral blood mononuclear cells. Antioxidant and antimicrobial activity. Methyl p-coumarate (Methyl 4-hydroxycinnamate), an esterified derivative of p-Coumaric acid (pCA), is isolated from the flower of Trixis michuacana var longifolia. Methyl p-coumarate could inhibit the melanin formation in B16 mouse melanoma cells. Methyl p-coumarate also has strong in vitro inhibitory effect on A. alternata and other pathogens[1][2]. Methyl p-coumarate (Methyl 4-hydroxycinnamate), an esterified derivative of p-Coumaric acid (pCA), is isolated from the flower of Trixis michuacana var longifolia. Methyl p-coumarate could inhibit the melanin formation in B16 mouse melanoma cells. Methyl p-coumarate also has strong in vitro inhibitory effect on A. alternata and other pathogens[1][2].
(E)-Methyl-4-hydroxycinnamate
(E)-Methyl 4-coumarate (Methyl 4-hydroxycinnamate), found in several plants, such as Allium cepa or Morinda citrifolia L. leaves. (E)-Methyl 4-coumarate cooperates with Carnosic Acid in inducing apoptosis and killing acute myeloid leukemia cells, but not normal peripheral blood mononuclear cells. Antioxidant and antimicrobial activity. (E)-Methyl 4-coumarate (Methyl 4-hydroxycinnamate), found in several plants, such as Allium cepa or Morinda citrifolia L. leaves. (E)-Methyl 4-coumarate cooperates with Carnosic Acid in inducing apoptosis and killing acute myeloid leukemia cells, but not normal peripheral blood mononuclear cells. Antioxidant and antimicrobial activity.
2,3-Dihydro-6,7-dihydroxy-1H-indene-4-carboxaldehyde
coniferyl aldehyde
Annotation level-1 Coniferaldehyde (Ferulaldehyde) is an effective inducer of heme oxygenase-1 (HO-1). Coniferaldehyde exerts anti-inflammatory properties in response to LPS. Coniferaldehyde inhibits LPS-induced apoptosis through the PKCα/β II/Nrf-2/HO-1 dependent pathway in RAW264.7 macrophage cells[1]. Coniferaldehyde (Ferulaldehyde) is an effective inducer of heme oxygenase-1 (HO-1). Coniferaldehyde exerts anti-inflammatory properties in response to LPS. Coniferaldehyde inhibits LPS-induced apoptosis through the PKCα/β II/Nrf-2/HO-1 dependent pathway in RAW264.7 macrophage cells[1].
Gluconolactone
C26170 - Protective Agent > C275 - Antioxidant D-(+)-Glucono-1,5-lactone is a polyhydroxy (PHA) that is capable of metal chelating, moisturizing and antioxidant activity.
3-C-carboxy-5-deoxy-alpha,beta-L-xylose|3-C-carboxy-5-deoxy-L-xylose|aceric acid|alpha,beta-L-aceric acid
9-hydroxy-non-7t-ene-3,5-diynoic acid methyl ester|Methyl-9-hydroxy-non-trans-7-en-3,5-diinoat|trans-9-Hydroxy-non-7-en-3,5-diinsaeure-methylester
2-Hydroxy-2,6-dimethylbenzofuran-3(2H)-one
A natural product found in Eupatorium cannabinum subspecies asiaticum.
3-methyl-3,4-dihydrobenzo[c][1,2]dioxine-5-carbaldehyde|bombaxoin
4-(o-Hydroxy-phenyl)-but-3-en-1-saeure|4--but-3-en-1-saeure
L-erythro-2-hydroxy-3-methoxy-glutaric acid|L-erythro-2-Hydroxy-3-methoxy-glutarsaeure
Osmundacetone
(E)-3,4-Dihydroxybenzylideneacetone is a natural product found in Inonotus obliquus, Peltigera dolichorrhiza, and Phellinus igniarius with data available. (E)-Osmundacetone is the isomer of Osmundacetone. Osmundacetone significantly suppresses the phosphorylation of MAPKs, including JNK, ERK, and p38 kinases. Osmundacetone has a neuroprotective effect against oxidative stress[1]. (E)-Osmundacetone is the isomer of Osmundacetone. Osmundacetone significantly suppresses the phosphorylation of MAPKs, including JNK, ERK, and p38 kinases. Osmundacetone has a neuroprotective effect against oxidative stress[1]. (E)-Osmundacetone is the isomer of Osmundacetone. Osmundacetone significantly suppresses the phosphorylation of MAPKs, including JNK, ERK, and p38 kinases. Osmundacetone has a neuroprotective effect against oxidative stress[1].
2-Methoxycinnamic acid
Annotation level-1 2-Methoxycinnamic acid is a noncompetitive inhibitor of tyrosinase[1]. 2-Methoxycinnamic acid is a noncompetitive inhibitor of tyrosinase[1].
4-methoxycinnamic acid
Annotation level-1 CONFIDENCE standard compound; INTERNAL_ID 8214 (E)-3-(4-Methoxyphenyl)acrylic acid (compound 3) is isolated from Arachis hypogaea, Scrophularia buergeriana Miquel, Aquilegia vulgaris, Anigozanthos preissii and so on. (E)-3-(4-Methoxyphenyl)acrylic acid shows significant hepatoprotective activity, anti-amnesic, cognition-enhancing activity, antihyperglycemic, and neuroprotective activities[1]. (E)-3-(4-Methoxyphenyl)acrylic acid (compound 3) is isolated from Arachis hypogaea, Scrophularia buergeriana Miquel, Aquilegia vulgaris, Anigozanthos preissii and so on. (E)-3-(4-Methoxyphenyl)acrylic acid shows significant hepatoprotective activity, anti-amnesic, cognition-enhancing activity, antihyperglycemic, and neuroprotective activities[1]. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii.
4-(Dimethylamino)phenylthiocyanate
CONFIDENCE standard compound; INTERNAL_ID 1116; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8921; ORIGINAL_PRECURSOR_SCAN_NO 8919 CONFIDENCE standard compound; INTERNAL_ID 1116; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9010; ORIGINAL_PRECURSOR_SCAN_NO 9009 CONFIDENCE standard compound; INTERNAL_ID 1116; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9030; ORIGINAL_PRECURSOR_SCAN_NO 9029 CONFIDENCE standard compound; INTERNAL_ID 1116; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9059; ORIGINAL_PRECURSOR_SCAN_NO 9057 CONFIDENCE standard compound; INTERNAL_ID 1116; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9076; ORIGINAL_PRECURSOR_SCAN_NO 9075 CONFIDENCE standard compound; INTERNAL_ID 1116; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9058; ORIGINAL_PRECURSOR_SCAN_NO 9056
L-Gulonolactone
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS L-Gulono-1,4-lactone is a substrate of L-gulono-1,4-lactone oxidoreductase, which catalyzes the last step of the biosynthesis of L-ascorbic (Vatamin) C. In other words, L-Gulono-1,4-lactone is a direct precursor of vitamin C in animals, in plants and in some protists.
Delta-Gluconolactone
D-(+)-Glucono-1,5-lactone is a polyhydroxy (PHA) that is capable of metal chelating, moisturizing and antioxidant activity.
(±)-Mellein
D009676 - Noxae > D011042 - Poisons > D009793 - Ochratoxins D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
Pyrido[2,3-b]pyrazin-2(1H)-one, 3-amino-8-hydroxy- (9CI)
1H-1,2,3-Triazolo[4,5-c]pyridine-1-carboxylic acid,methyl ester
ENDO-BICYCLO[2.2.2]OCT-5-ENE-2,3-DICARBOXYLIC ANHYDRIDE
2H-Benzimidazole-2-thione,1-ethyl-1,3-dihydro-(9CI)
2-ethylsulfanyl-1H-benzimidazole
D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D020011 - Protective Agents > D000975 - Antioxidants D007155 - Immunologic Factors
(R)-Hexahydro-oxazolo[3,4-a]pyrazin-3-one hydrochloride
2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetonitrile
2-AMINO-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE
Bicyclo<2.2.2>oct-2-ene-2,3-dicarboxylic anhydride
Acetamide,2-chloro-N-[[(1-methylethyl)amino]carbonyl]-
Tirapazamine
C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent D011838 - Radiation-Sensitizing Agents D000970 - Antineoplastic Agents C2077 - Bioreductive Agent
(Z)-3-(3-hydroxyphenyl)-2-methyl-prop-2-enoic acid
1H-Benzimidazole-2-carboxaldehyde,1-(fluoromethyl)-(9CI)
1-(2-aminoethyl)-2,5-pyrrolidinedione(SALTDATA: HCl 0.25H2O)
methyl [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
4-amino-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid
7-methyl-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde(SALTDATA: FREE)
(3S,4S)-4-azidotetrahydro-2H-pyran-3-amine hydrochloride
(2E)-3-(4-Hydroxy-2-methylphenyl)-2-propenoic acid
2-aminopyrazolo[1,5-a]pyrimidine-3-carboxylic acid
2H-Benzimidazole-2-thione,1,3-dihydro-5,6-dimethyl-
Carbonic acid,C,C-1,2-ethanediyl C,C-dimethyl ester
Cyclohexylsulfamate
An organic sulfamate oxoanion that is the conjugate base of cyclohexylsulfamic acid.
p-MCA
(E)-3-(4-Methoxyphenyl)acrylic acid (compound 3) is isolated from Arachis hypogaea, Scrophularia buergeriana Miquel, Aquilegia vulgaris, Anigozanthos preissii and so on. (E)-3-(4-Methoxyphenyl)acrylic acid shows significant hepatoprotective activity, anti-amnesic, cognition-enhancing activity, antihyperglycemic, and neuroprotective activities[1]. (E)-3-(4-Methoxyphenyl)acrylic acid (compound 3) is isolated from Arachis hypogaea, Scrophularia buergeriana Miquel, Aquilegia vulgaris, Anigozanthos preissii and so on. (E)-3-(4-Methoxyphenyl)acrylic acid shows significant hepatoprotective activity, anti-amnesic, cognition-enhancing activity, antihyperglycemic, and neuroprotective activities[1]. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii. 4-Methoxycinnamic acid is detected as natural phenylpropanoid in A. preissii.
FR-2261
(E)-Methyl 4-coumarate (Methyl 4-hydroxycinnamate), found in several plants, such as Allium cepa or Morinda citrifolia L. leaves. (E)-Methyl 4-coumarate cooperates with Carnosic Acid in inducing apoptosis and killing acute myeloid leukemia cells, but not normal peripheral blood mononuclear cells. Antioxidant and antimicrobial activity. (E)-Methyl 4-coumarate (Methyl 4-hydroxycinnamate), found in several plants, such as Allium cepa or Morinda citrifolia L. leaves. (E)-Methyl 4-coumarate cooperates with Carnosic Acid in inducing apoptosis and killing acute myeloid leukemia cells, but not normal peripheral blood mononuclear cells. Antioxidant and antimicrobial activity. Methyl p-coumarate (Methyl 4-hydroxycinnamate), an esterified derivative of p-Coumaric acid (pCA), is isolated from the flower of Trixis michuacana var longifolia. Methyl p-coumarate could inhibit the melanin formation in B16 mouse melanoma cells. Methyl p-coumarate also has strong in vitro inhibitory effect on A. alternata and other pathogens[1][2]. Methyl p-coumarate (Methyl 4-hydroxycinnamate), an esterified derivative of p-Coumaric acid (pCA), is isolated from the flower of Trixis michuacana var longifolia. Methyl p-coumarate could inhibit the melanin formation in B16 mouse melanoma cells. Methyl p-coumarate also has strong in vitro inhibitory effect on A. alternata and other pathogens[1][2].
Ferulaldehyde
Coniferaldehyde (Ferulaldehyde) is an effective inducer of heme oxygenase-1 (HO-1). Coniferaldehyde exerts anti-inflammatory properties in response to LPS. Coniferaldehyde inhibits LPS-induced apoptosis through the PKCα/β II/Nrf-2/HO-1 dependent pathway in RAW264.7 macrophage cells[1]. Coniferaldehyde (Ferulaldehyde) is an effective inducer of heme oxygenase-1 (HO-1). Coniferaldehyde exerts anti-inflammatory properties in response to LPS. Coniferaldehyde inhibits LPS-induced apoptosis through the PKCα/β II/Nrf-2/HO-1 dependent pathway in RAW264.7 macrophage cells[1].
5,6-Dihydro-2,4,5-trihydroxy-6-(hydroxymethyl)-2H-pyran-3(4H)-one
1-(2-Hydroxy-4-methylphenyl)propan-1,2-dione
A natural product found in Eupatorium cannabinum subspecies asiaticum.
2-Aminobenzoylacetate
A 3-oxo monocarboxylic acid anion obtained by deprotonation of the carboxy group of 2-aminobenzoylacetic acid; major species at pH 7.3.
(2S,3R)-2-amino-3-hydroxy-5-(hydroxyamino)-5-oxopentanoic acid
(4R,5R)-5-(1,2-dihydroxyethyl)-3,4-dihydroxy-2-oxolanone
L-Galactono-1,4-lactone
A galactonolactone that is 3,4-dihydroxydihydrofuran-2(3H)-one substituted by a 1,2-dihydroxyethyl group at position 5 (the 3S,4S,5R-isomer).
D-Gulono-1,4-lactone
1,4-D-Gulonolactone is an endogenous metabolite.
3,6-anhydro-L-galactonic acid
An anhydrohexose obtained by formation of a ring across the 3 and 6 positions of L-galactonic acid
(2S,3R,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carbaldehyde
N-Benzoylglycinate
An alpha-amino-acid anion that is the conjugate base of N-benzoylglycine; major species at pH 7.3.
Difurfuryl ether
A member of the class of furans that is furan which is substituted by a (furan-2-ylmethoxy)methyl group at position 2.
Ethyl Phenylglyoxylate
The ethyl ester of phenylglyoxylic acid. Metabolite observed in cancer metabolism.
1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene
2-Dehydro-3-deoxy-D-galactonic acid
The 2-dehydro-3-deoxy derivative of D-galactonic acid.
2-dehydro-3-deoxy-D-gluconic acid
The 2-dehydro-3-deoxy derivative of D-gluconic acid.
4-coumaric acid methyl ester
A cinnamate ester that is the methyl ester of 4-coumaric acid.
L-Gulono-1,4-lactone
The furanose form of gulonolactone having L-configuration.
(2s)-5-hydroxy-2-methyl-2,3-dihydro-1-benzopyran-4-one
(1r,4r,7s,8s)-2,5-dioxabicyclo[2.2.2]octane-1,4,7,8-tetrol
3,4-dihydro-8-hydroxy-3-methyl-2 h -1-benzopyran-2-one
{"Ingredient_id": "HBIN007364","Ingredient_name": "3,4-dihydro-8-hydroxy-3-methyl-2 h -1-benzopyran-2-one","Alias": "NA","Ingredient_formula": "C10H10O3","Ingredient_Smile": "CC1CC2=C(C(=CC=C2)O)OC1=O","Ingredient_weight": "178.18","OB_score": "NA","CAS_id": "52685-66-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8289","PubChem_id": "21828374","DrugBank_id": "NA"}
(4r)-4,8-dihydroxy-α-tetralone
{"Ingredient_id": "HBIN010847","Ingredient_name": "(4r)-4,8-dihydroxy-\u03b1-tetralone","Alias": "NA","Ingredient_formula": "C10H10O3","Ingredient_Smile": "C1CC(=O)C2=C(C1O)C=CC=C2O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6144","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
