Exact Mass: 224.06847019999998

Exact Mass Matches: 224.06847019999998

Found 500 metabolites which its exact mass value is equals to given mass value 224.06847019999998, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Flavanone

2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one

C15H12O2 (224.0837252)


Flavonoids (or bioflavonoids) (from the Latin word flavus meaning yellow), also collectively known as Vitamin P and citrin, are a class of plant secondary metabolites or yellow pigments having a structure similar to that of flavones. Flavonoids is found in many foods, some of which are blackcurrant, wild celery, rose hip, and turmeric. Flavanone is a naturally occurring flavone. Flavanone has inhibitory activity for human estrogen synthetase (aromatase)[1]. Flavanone is a naturally occurring flavone. Flavanone has inhibitory activity for human estrogen synthetase (aromatase)[1].

   

Sinapic acid

3,5-Dimethoxy-4-hydroxycinnamic acid, 4-Hydroxy-3,5-dimethoxy-cinnamic acid, Sinapinic acid

C11H12O5 (224.06847019999998)


Sinapic acid, also known as sinapinate, belongs to the class of organic compounds known as hydroxycinnamic acids. Hydroxycinnamic acids are compounds containing an cinnamic acid where the benzene ring is hydroxylated. Sinapic acid has been detected, but not quantified, in several different foods, such as strawberry guava, purple lavers, common verbena, ryes, and lupines. This could make sinapic acid a potential biomarker for the consumption of these foods. A sinapic acid in which the double bond has trans-configuration. Trans-sinapic acid is a sinapic acid in which the double bond has trans-configuration. It has a role as a MALDI matrix material and a plant metabolite. It is a conjugate acid of a trans-sinapate. Sinapic acid is a matrix for matrix-assisted laser desorption technique for protein MW determination. It is also a constituent of propolis. Sinapic acid is a natural product found in Sida acuta, Limoniastrum guyonianum, and other organisms with data available. A common constituent of plants and fruits. trans-Sinapic acid is found in many foods, some of which are small-leaf linden, redcurrant, malabar spinach, and blackcurrant. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents A sinapic acid in which the double bond has trans-configuration. Acquisition and generation of the data is financially supported in part by CREST/JST. Profile spectrum of this record is given as a JPEG file.; [Profile] MCH00014.jpg Profile spectrum of this record is given as a JPEG file.; [Profile] MCH00015.jpg CONFIDENCE standard compound; INTERNAL_ID 174 Annotation level-1 Annotation level-2 KEIO_ID S028 Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3]. Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3].

   

1-Hydroxyanthraquinone

1-hydroxy-9,10-dihydroanthracene-9,10-dione

C14H8O3 (224.0473418)


CONFIDENCE standard compound; INTERNAL_ID 8284 CONFIDENCE standard compound; INTERNAL_ID 25 D009676 - Noxae > D002273 - Carcinogens 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1]. 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1].

   

3-Hydroxyl kyneurenine

2-Amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid

C10H12N2O4 (224.0797032)


Hydroxykynurenine is a free radical generator and a bioprecursor quinolinic acid which is a endogenous excitotoxin (PMID 16697652). It is a product of enzyme kynurenine 3-monooxygenase in the tryptophan catabolism pathway (Reactome http://www.reactome.org). [HMDB] Hydroxykynurenine is a free radical generator and a bioprecursor quinolinic acid which is a endogenous excitotoxin (PMID 16697652). It is a product of enzyme kynurenine 3-monooxygenase in the tryptophan catabolism pathway (Reactome http://www.reactome.org). Acquisition and generation of the data is financially supported in part by CREST/JST. [Raw Data] CBA12_3-OH-kynurenine_pos_20eV_1-4_01_802.txt [Raw Data] CBA12_3-OH-kynurenine_pos_10eV_1-4_01_801.txt [Raw Data] CBA12_3-OH-kynurenine_pos_50eV_1-4_01_805.txt [Raw Data] CBA12_3-OH-kynurenine_pos_40eV_1-4_01_804.txt [Raw Data] CBA12_3-OH-kynurenine_pos_30eV_1-4_01_803.txt C26170 - Protective Agent > C275 - Antioxidant KEIO_ID H050; [MS3] KO009001 KEIO_ID H050; [MS2] KO009000 KEIO_ID H050

   

Gesfid

methyl (E)-3-dimethoxyphosphoryloxybut-2-enoate

C7H13O6P (224.0449728)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

Stavudine

1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

C10H12N2O4 (224.07970319999998)


Stavudine is only found in individuals that have used or taken this drug. It is a dideoxynucleoside analog that inhibits reverse transcriptase and has in vitro activity against HIV. [PubChem]Stavudine inhibits the activity of HIV-1 reverse transcriptase (RT) both by competing with the natural substrate dGTP and by its incorporation into viral DNA. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AF - Nucleoside and nucleotide reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97452 - Nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents D009676 - Noxae > D000963 - Antimetabolites > D015224 - Dideoxynucleosides D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent Stavudine (d4T) is an orally active nucleoside reverse transcriptase inhibitor (NRTI). Stavudine has activity against HIV-1 and HIV-2. Stavudine also inhibits the replication of mitochondrial DNA (mtDNA). Stavudine reduces NLRP3 inflammasome activation and modulates Amyloid-β autophagy. Stavudine induces apoptosis[1][2][3][4].

   

2-Hydroxychalcone

2-Propen-1-one,1-(2-hydroxyphenyl)-3-phenyl-, (2E)-

C15H12O2 (224.0837252)


   

4-Hydroxychalcone

1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one

C15H12O2 (224.0837252)


4'-Hydroxychalcone is a chalcone isolated from licorice root, with hepatoprotective activity. 4'-Hydroxychalcone inhibits TNFα-induced NF-κB activation via proteasome inhibition. 4'-Hydroxychalcone induces a rapid potassium release from mitochondrial vesicles and causes deterioration of respiratory control and oxidative phosphorylation of isolated rat liver mitochondria[1][2][3].

   

phenazine-1-carboxylic acid

Phenanzine-1-carboxylic acid

C13H8N2O2 (224.0585748)


An aromatic carboxylic acid that is phenazine substituted at C-1 with a carboxy group. CONFIDENCE standard compound; INTERNAL_ID 190 Phenazine-1-carboxylic acid exhibits strong antifungal activity against phytopathogenic fungi.

   

Isoflavanone

2,3-dihydro-3-Phenyl-4H-1-benzopyran-4-one

C15H12O2 (224.0837252)


   

5-Hydroxykynurenine

2-Amino-4-(2-amino-5-hydroxyphenyl)-4-oxobutanoic acid

C10H12N2O4 (224.07970319999998)


5-Hydroxykynurenine is found in the tryptophan metabolism pathway. It is created from 5-Hydroxy-N-formylkynurenine through the action of arylformamidase [EC:3.5.1.9]. 5-Hydroxykynurenine is then converted to 5-Hydroxykynurenamine by the action of dopa decarboxylase [EC:4.1.1.28]. [HMDB] 5-Hydroxykynurenine is found in the tryptophan metabolism pathway. It is created from 5-Hydroxy-N-formylkynurenine through the action of arylformamidase [EC:3.5.1.9]. 5-Hydroxykynurenine is then converted to 5-Hydroxykynurenamine by the action of dopa decarboxylase [EC:4.1.1.28].

   

4-Hydroxychalcone

(2Z)-3-(4-hydroxyphenyl)-1-phenylprop-2-en-1-one

C15H12O2 (224.0837252)


4-Hydroxychalcone is found in herbs and spices. 4-Hydroxychalcone is a constituent of Glycyrrhiza glabra (licorice) roots 4-Hydroxychalcone is a chalcone metabolite with anti-angiogenic and anti-inflammatory activities. 4-Hydroxychalcone suppresses angiogenesis by suppression of growth factor pathway with no signs of cytotoxicity[1]. 4-Hydroxychalcone inhibits TNF-α induced NF-κB pathway activation and activates BMP signaling, reduces resistant hypertension (RH) by attenuating hyperaldosteronism and renal injury in mice[2].

   

1-Methoxy-2-hydroxyanthracene

1-Methoxy-2-hydroxyanthracene

C15H12O2 (224.0837252)


   

NIFURADENE

2-Imidazolidinone,1-[[(5-nitro-2-furanyl)methylene]amino]-

C8H8N4O4 (224.05455279999998)


C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent

   
   
   

L-3-Hydroxykynurenine

(2S)-2-Amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid

C10H12N2O4 (224.07970319999998)


L-3-Hydroxykynurenine (L-3-HK) is a metabolite in the kynurenine pathway, the major route of tryptophan degradation in mammals. Kynurenine 3-monooxygenase, an NADPH-dependent flavin monooxygenase, catalyses the hydroxylation of L-kynurenine to L-3-hydroxykynurenine. 3-hydroxykynurenine can be converted to 3-hydroxyanthranilate by the enzyme 3-hydroxykinureninase. It may also be converted to 4-(2-amino-3-hydroxphenyl)-2,4-dioxobutanoate by the enzyme kynurenine-oxoglutarate transaminase. L-3-Hydroxykynurenine (L-3-HK) is a known generator of highly reactive free radicals. An elevation of L-3-HK levels has been shown to constitute a significant hazard in situations of excitotoxic injury. In particular, L-3-HK may contribute to the neuronal deficits underlying HIV-associated dementia (PMID: 7830088). Pharmacological interventions aimed at decreasing L-3-HK formation may therefore be particularly useful for the treatment of neurological diseases which are associated with an abnormally enhanced flux through the kynurenine pathway (PMID: 10583474) [HMDB] L-3-Hydroxykynurenine (L-3-HK) is a metabolite in the kynurenine pathway, the major route of tryptophan degradation in mammals. Kynurenine 3-monooxygenase, an NADPH-dependent flavin monooxygenase, catalyses the hydroxylation of L-kynurenine to L-3-hydroxykynurenine. 3-hydroxykynurenine can be converted to 3-hydroxyanthranilate by the enzyme 3-hydroxykinureninase. It may also be converted to 4-(2-amino-3-hydroxphenyl)-2,4-dioxobutanoate by the enzyme kynurenine-oxoglutarate transaminase. L-3-Hydroxykynurenine (L-3-HK) is a known generator of highly reactive free radicals. An elevation of L-3-HK levels has been shown to constitute a significant hazard in situations of excitotoxic injury. In particular, L-3-HK may contribute to the neuronal deficits underlying HIV-associated dementia (PMID: 7830088). Pharmacological interventions aimed at decreasing L-3-HK formation may therefore be particularly useful for the treatment of neurological diseases which are associated with an abnormally enhanced flux through the kynurenine pathway (PMID: 10583474).

   

Flavanone

(2S)-Flavanone

C15H12O2 (224.0837252)


Annotation level-1 Flavanone is a naturally occurring flavone. Flavanone has inhibitory activity for human estrogen synthetase (aromatase)[1]. Flavanone is a naturally occurring flavone. Flavanone has inhibitory activity for human estrogen synthetase (aromatase)[1].

   
   

Flavanone

Propafenone Hydrochloride Imp. H (EP); Propafenone Imp. H (EP); (2RS)-2-Phenyl-2,3-dihydro-4H-1-benzopyran-4-one; Propafenone Hydrochloride Impurity H; Propafenone Impurity H

C15H12O2 (224.0837252)


Flavanone is the simplest member of the class of flavanones that consists of flavan bearing an oxo substituent at position 4. It derives from a hydride of a flavan. Flavanone is a natural product found in Annona muricata, Ginkgo biloba, and other organisms with data available. The simplest member of the class of flavanones that consists of flavan bearing an oxo substituent at position 4. Flavanone is a naturally occurring flavone. Flavanone has inhibitory activity for human estrogen synthetase (aromatase)[1]. Flavanone is a naturally occurring flavone. Flavanone has inhibitory activity for human estrogen synthetase (aromatase)[1].

   

Hydroxyanthraquinone

InChI=1/C14H8O3/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7,15

C14H8O3 (224.0473418)


1-hydroxyanthraquinone is a monohydroxyanthraquinone. 1-Hydroxyanthraquinone is a natural product found in Rheum palmatum, Handroanthus impetiginosus, and Morinda citrifolia with data available. D009676 - Noxae > D002273 - Carcinogens 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1]. 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1].

   

N-Methoxy-1-vinyl-beta-carboline

1-ethenyl-9-methoxy-9H-pyrido[3,4-b]indole

C14H12N2O (224.09495819999998)


N-Methoxy-1-vinyl-beta-carboline is an alkaloid from Picrasma excelsa (Jamaican quassiawood

   

Elenolide

Methyl 2-oxo-4-[(2Z)-1-oxobut-2-en-2-yl]-3,4-dihydro-2H-pyran-5-carboxylic acid

C11H12O5 (224.06847019999998)


Constituent of olive oil. Elenolide is found in many foods, some of which are fats and oils, olive, pomes, and herbs and spices. Elenolide is found in fats and oils. Elenolide is a constituent of olive oil

   

Temurin

1,3,7,9-Tetramethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione

C9H12N4O3 (224.0909362)


Temurin is a methyl derivative of uric acid, found occasionally in human urine. Temurin is one of the purine components in urinary calculi. Methylated purines originate from the metabolism of methylxanthines (caffeine, theophylline and theobromine). Methyluric acids are indistinguishable from uric acid by simple methods routinely used in clinical laboratories, requiring the use of high-performance liquid chromatography (HPLC). Purine derivatives in urinary calculi could be considered markers of abnormal purine metabolism. The content of a purine derivative in stone depends on its average urinary excretion in the general population, similarity to the chemical structure of uric acid, and content of the latter in stone. This suggests that purines in stones represent a solid solution with uric acid as solvent. It is also plausible that methylxanthines, ubiquitous components of the diet and drugs, are involved in the pathogenesis of urolithiasis. (PMID: 11712316, 15833286, 3506820, 15013152). Isolated from tea

   

L-Nicotianine

1-(3-amino-3-carboxypropyl)pyridin-1-ium-3-carboxylate

C10H12N2O4 (224.07970319999998)


L-Nicotianine is found in mushrooms. L-Nicotianine is a constituent of Lentinus edodes (shiitake)

   

Propyl 1-(propylthio)propyl disulfide

1-(Propyldisulphanyl)-1-(propylsulphanyl)propane

C9H20S3 (224.07270800000003)


Propyl 1-(propylthio)propyl disulfide is found in onion-family vegetables. Propyl 1-(propylthio)propyl disulfide is a constituent of Allium cepa (onion) and Allium fistulosum (Welsh onion). Constituent of Allium cepa (onion) and Allium fistulosum (Welsh onion). Propyl 1-(propylthio)propyl disulfide is found in garden onion and onion-family vegetables.

   

cis-Sinapic acid

(2Z)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid

C11H12O5 (224.06847019999998)


cis-Sinapic acid is found in pulses. cis-Sinapic acid is a constituent of shoots of Medicago sativa (alfalfa). Constituent of shoots of Medicago sativa (alfalfa). cis-Sinapic acid is found in pulses and common pea. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone

C11H12O5 (224.06847019999998)


5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]

   

2-Oxo-2-(3,4,5-trimethoxyphenyl)acetaldehyde

2-Oxo-2-(3,4,5-trimethoxyphenyl)acetaldehyde

C11H12O5 (224.06847019999998)


   

6-[(1Z,2Z)-3-Hydroxy-3-phenyl-2-propene-1-ylidene]-2,4-cyclohexadiene-1-one

6-[(1Z,2Z)-3-Hydroxy-3-phenyl-2-propene-1-ylidene]-2,4-cyclohexadiene-1-one

C15H12O2 (224.0837252)


   

8-(2-Hydroxyethyl)theophyline

8-(2-hydroxyethyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

C9H12N4O3 (224.0909362)


   

7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine

7-methyl-6,8-bis(methylsulfanyl)pyrrolo[1,2-a]pyrazine

C10H12N2S2 (224.04418719999998)


   

9H-Fluoren-9-ylmethyl Formate

9H-Fluoren-9-ylmethyl formic acid

C15H12O2 (224.0837252)


   

2,3-Diphenylacrylic acid

2,3-diphenylprop-2-enoic acid

C15H12O2 (224.0837252)


   

Pterocarpan

8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2,4,6,11,13,15-hexaene

C15H12O2 (224.0837252)


   

cis-Mevinphos

Methyl 3-hydroxycrotonic acid dimethyl phosphoric acid ester

C7H13O6P (224.0449728)


   

Dibenzoylmethane

1,3-Diphenylpropane-1,3-dione

C15H12O2 (224.0837252)


Dibenzoylmethane, a minor ingredient in licorice, activates Nrf2 and prevents various cancers and oxidative damage. Dibenzoylmethane, an analog of curcumin, results in dissociation from Keap1 and nuclear translocation of Nrf2[1]. Dibenzoylmethane, a minor ingredient in licorice, activates Nrf2 and prevents various cancers and oxidative damage. Dibenzoylmethane, an analog of curcumin, results in dissociation from Keap1 and nuclear translocation of Nrf2[1].

   

Etofylline

7-(2-hydroxyethyl)-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

C9H12N4O3 (224.0909362)


   

Phenylbenzylglyoxal

1,3-diphenylpropane-1,2-dione

C15H12O2 (224.0837252)


   

(3As)-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide

8lambda6-thia-2,7-diazatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-triene-8,8-dione

C10H12N2O2S (224.0619452)


   

6-epi-5-Hydroxy-mycosporulone

(-)-6-epi-5-Hydroxy-mycosporulone

C11H12O5 (224.06847019999998)


   
   
   
   
   
   
   
   

trans-sinapic acid

(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)acrylic acid

C11H12O5 (224.06847019999998)


   
   
   
   

Isoflavanone

Isoflavanone

C15H12O2 (224.0837252)


Isoflavone in which the double bond between positions 2 and 3 has been reduced to a single bond.

   

Trinexapac

Trinexapac-ethyl

C11H12O5 (224.06847019999998)


A monocarboxylic acid that is 3,5-dioxocyclohexanecarboxylic acid substituted by a cyclopropyl(hydroxy)methylidene group at position 4. It is a metabolite of the plant growth regulator trinexapac-ethyl. CONFIDENCE standard compound; EAWAG_UCHEM_ID 150

   

Dibenzoylmethane

Dibenzoylmethane 1,3-Diphenyl-1,3-propanedione

C15H12O2 (224.0837252)


Dibenzoylmethane is a beta-diketone that is acetylacetone (acac) in which both methyl groups have been replaced by phenyl groups. It is a minor constituent of the root extract of licorice (Glycyrrhiza glabra) and exhibits antimutagenic and anticancer effects. It has a role as an antineoplastic agent, a metabolite and an antimutagen. It is a beta-diketone and an aromatic ketone. Dibenzoylmethane is a natural product found in Acca sellowiana with data available. A beta-diketone that is acetylacetone (acac) in which both methyl groups have been replaced by phenyl groups. It is a minor constituent of the root extract of licorice (Glycyrrhiza glabra) and exhibits antimutagenic and anticancer effects. Dibenzoylmethane, a minor ingredient in licorice, activates Nrf2 and prevents various cancers and oxidative damage. Dibenzoylmethane, an analog of curcumin, results in dissociation from Keap1 and nuclear translocation of Nrf2[1]. Dibenzoylmethane, a minor ingredient in licorice, activates Nrf2 and prevents various cancers and oxidative damage. Dibenzoylmethane, an analog of curcumin, results in dissociation from Keap1 and nuclear translocation of Nrf2[1].

   

4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydro-1h-isochromen-1-one

4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydro-1h-isochromen-1-one

C11H12O5 (224.06847019999998)


   

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid

C11H12O5 (224.06847019999998)


   

7-(2-Hydroxyethyl)theophylline

7-(2-Hydroxyethyl)theophylline

C9H12N4O3 (224.0909362)


D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu); Flow Injection CONFIDENCE Reference Standard (Level 1); HBM4EU - science and policy for a healthy future (https://www.hbm4eu.eu)

   

2-Hydroxyanthraquinone

2-Hydroxyanthraquinone

C14H8O3 (224.0473418)


CONFIDENCE standard compound; INTERNAL_ID 24 CONFIDENCE standard compound; INTERNAL_ID 8289 CONFIDENCE standard compound; INTERNAL_ID 8144 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1]. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1].

   
   

4-(3-chlorophenyl)piperazine-1-carbaldehyde

4-(3-chlorophenyl)piperazine-1-carbaldehyde

C11H13ClN2O (224.0716358)


   
   

1-(3-acetyl-2,4-dihydroxy-6-methoxyphenyl)ethan-1-one

1-(3-acetyl-2,4-dihydroxy-6-methoxyphenyl)ethan-1-one

C11H12O5 (224.06847019999998)


   
   

(E)-2-hydroxyethyl 3-(3,4-dihydroxyphenyl)acrylate|2-hydroxyethyl caffeate|hydroxyethyl caffeate

(E)-2-hydroxyethyl 3-(3,4-dihydroxyphenyl)acrylate|2-hydroxyethyl caffeate|hydroxyethyl caffeate

C11H12O5 (224.06847019999998)


   

(beta,beta-Dihydroxy-isopropyl)-beta-D-xylopyranosid|(beta,beta-dihydroxy-isopropyl)-beta-D-xylopyranoside|2-Desoxyglycer-2-yl-beta-D-xylopyranosid|2-O-beta-D-Xylopyranosylglycerin|<2-Hydroxy-1-hydroxymethyl-aethyl>-beta-D-xylopyranosid

(beta,beta-Dihydroxy-isopropyl)-beta-D-xylopyranosid|(beta,beta-dihydroxy-isopropyl)-beta-D-xylopyranoside|2-Desoxyglycer-2-yl-beta-D-xylopyranosid|2-O-beta-D-Xylopyranosylglycerin|<2-Hydroxy-1-hydroxymethyl-aethyl>-beta-D-xylopyranosid

C8H16O7 (224.0895986)


   

methyl 2-acetyl-3,5-dihydroxyphenylacetate

methyl 2-acetyl-3,5-dihydroxyphenylacetate

C11H12O5 (224.06847019999998)


   
   
   
   

1-Methoxy-5,7-Dihydroxy-4,6-dimethyl-1(3H)-isobenzofuranone|5,7-Dihydroxy-4-(methoxymethyl)-6-methyl-1(3H)-isobenzofuranon

1-Methoxy-5,7-Dihydroxy-4,6-dimethyl-1(3H)-isobenzofuranone|5,7-Dihydroxy-4-(methoxymethyl)-6-methyl-1(3H)-isobenzofuranon

C11H12O5 (224.06847019999998)


   
   
   
   

SCHEMBL22688963

SCHEMBL22688963

C7H12O8 (224.0532152)


   

7-acetoxy-1-phenylhept-5E-ene-1,3-diyne|Ac-(E)-7-Phenyl-2-heptene-4,6-diyn-1-ol|Acetat des 1-Phenyl-hepten-(5)-trans-diin-(1.3)-ols-(7)|acetic acid-(7-phenyl-hept-2t-ene-4,6-diynyl ester)|Essigsaeure-(7-phenyl-hept-2t-en-4,6-diinylester)|trans-1-Phenyl-hepten-(5)-diin-(1,3)-yl-(7)-acetat

7-acetoxy-1-phenylhept-5E-ene-1,3-diyne|Ac-(E)-7-Phenyl-2-heptene-4,6-diyn-1-ol|Acetat des 1-Phenyl-hepten-(5)-trans-diin-(1.3)-ols-(7)|acetic acid-(7-phenyl-hept-2t-ene-4,6-diynyl ester)|Essigsaeure-(7-phenyl-hept-2t-en-4,6-diinylester)|trans-1-Phenyl-hepten-(5)-diin-(1,3)-yl-(7)-acetat

C15H12O2 (224.0837252)


   

ethyl 1-thio-alpha-d-glucopyranoside

ethyl 1-thio-alpha-d-glucopyranoside

C8H16O5S (224.0718406)


   

3-Methyl-4-(2,3-dihydroxyphenyl)-4-oxo-butanoic acid

3-Methyl-4-(2,3-dihydroxyphenyl)-4-oxo-butanoic acid

C11H12O5 (224.06847019999998)


   
   
   
   
   

3-Acetyl-2,6-dihydroxy-4-methoxy-5-methyl-benzaldehyd|3-Acetyl-2,6-dihydroxy-4-methoxy-5-methylbenzaldehyde|3-formyl-2,4-dihydroxy-5-methyl-6-methoxy-acetophenone|Kosin 16

3-Acetyl-2,6-dihydroxy-4-methoxy-5-methyl-benzaldehyd|3-Acetyl-2,6-dihydroxy-4-methoxy-5-methylbenzaldehyde|3-formyl-2,4-dihydroxy-5-methyl-6-methoxy-acetophenone|Kosin 16

C11H12O5 (224.06847019999998)


   
   

1,3-diphenyl-1,2-propanedione

1,3-diphenyl-1,2-propanedione

C15H12O2 (224.0837252)


   

3-(4-methoxy-3,5-dimethyl-2-oxo-2h-pyran-6-yl)-2-propenoic acid

3-(4-methoxy-3,5-dimethyl-2-oxo-2h-pyran-6-yl)-2-propenoic acid

C11H12O5 (224.06847019999998)


   
   

(3S,4S)-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone|3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone

(3S,4S)-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone|3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone

C11H12O5 (224.06847019999998)


   
   

4-Acetoxy-3,5-dimethoxybenzaldehyde

4-Acetoxy-3,5-dimethoxybenzaldehyde

C11H12O5 (224.06847019999998)


   

3,4,8-trihydroxy-6-(hydroxymethyl)-3,4-dihydronaphthalen-1(2H)-one

3,4,8-trihydroxy-6-(hydroxymethyl)-3,4-dihydronaphthalen-1(2H)-one

C11H12O5 (224.06847019999998)


   

3-methoxy-6,8-dihydroxy-3-methyl-3,4-dihydroisocoumarin

3-methoxy-6,8-dihydroxy-3-methyl-3,4-dihydroisocoumarin

C11H12O5 (224.06847019999998)


   

1-[rel-(2S,3S)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]ethanone

1-[rel-(2S,3S)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]ethanone

C11H12O5 (224.06847019999998)


   

Methyl 4-(acetyloxy)-3-methoxybenzoate

Methyl 4-(acetyloxy)-3-methoxybenzoate

C11H12O5 (224.06847019999998)


   
   

4-(1-Hydroxyethyl)-6,8-dihydroxy-3,4-dihydro-1H-2-benzopyran-1-one

4-(1-Hydroxyethyl)-6,8-dihydroxy-3,4-dihydro-1H-2-benzopyran-1-one

C11H12O5 (224.06847019999998)


   

3-acetyl-2,4-dihydroxy-6-methoxy-5-methylbenzaldehyde

3-acetyl-2,4-dihydroxy-6-methoxy-5-methylbenzaldehyde

C11H12O5 (224.06847019999998)


   

2-Acetyl-4,6-dimethoxybenzoic acid

2-Acetyl-4,6-dimethoxybenzoic acid

C11H12O5 (224.06847019999998)


   
   

7-methyl-2,6-phenanthrenediol

7-methyl-2,6-phenanthrenediol

C15H12O2 (224.0837252)


   
   
   
   

(+)-pestaphthalide A|5,7-dihydroxy-3-(1-hydroxyethyl)-6-methyl-3H-isobenzofuran-1-one|pestaphthalide A

(+)-pestaphthalide A|5,7-dihydroxy-3-(1-hydroxyethyl)-6-methyl-3H-isobenzofuran-1-one|pestaphthalide A

C11H12O5 (224.06847019999998)


   
   
   
   
   
   

3-Hydroxy-4-hydroxymethyl-7-methoxy-6-methyl-phthalid|3-hydroxy-4-hydroxymethyl-7-methoxy-6-methyl-phthalide

3-Hydroxy-4-hydroxymethyl-7-methoxy-6-methyl-phthalid|3-hydroxy-4-hydroxymethyl-7-methoxy-6-methyl-phthalide

C11H12O5 (224.06847019999998)


   
   

cis,cis-Tridecatrien-(2,10,12)-triin-(4,6,8)-yl-acetat

cis,cis-Tridecatrien-(2,10,12)-triin-(4,6,8)-yl-acetat

C15H12O2 (224.0837252)


   

2,5-Dihydroxy-2-methyl-7-methoxychroman-4-one

2,5-Dihydroxy-2-methyl-7-methoxychroman-4-one

C11H12O5 (224.06847019999998)


   
   

Di-Me ether-3,5,7,9,11-Tridecapentayne-1,2-diol

Di-Me ether-3,5,7,9,11-Tridecapentayne-1,2-diol

C15H12O2 (224.0837252)


   

2-formyl-3,5-dimethoxy-6-methylbenzoic acid

2-formyl-3,5-dimethoxy-6-methylbenzoic acid

C11H12O5 (224.06847019999998)


   
   

alpha-O-Ac-Shanorellin|Shanorellinacetat

alpha-O-Ac-Shanorellin|Shanorellinacetat

C11H12O5 (224.06847019999998)


   
   

Methyl 6-methoxy-2-methyl-3,4-methylene dioxybenzoate

Methyl 6-methoxy-2-methyl-3,4-methylene dioxybenzoate

C11H12O5 (224.06847019999998)


   

SCHEMBL21202086

SCHEMBL21202086

C8H16O7 (224.0895986)


   

6-Me ether-3,5,6-Trihydroxy-3-menthyl-1H-2-benzopyran-4-one

6-Me ether-3,5,6-Trihydroxy-3-menthyl-1H-2-benzopyran-4-one

C11H12O5 (224.06847019999998)


   

Et glycoside-alpha-D-Furanose--1-Thioglucose

Et glycoside-alpha-D-Furanose--1-Thioglucose

C8H16O5S (224.0718406)


   

4-vinylphenyl benzoate

4-vinylphenyl benzoate

C15H12O2 (224.0837252)


   

(3Z,5E)-octa-3,5-diene-1,3,4-tricarboxylic acid 3,4-anhydride|(3Z,5E)-Octa-3,5-diene-1,3,4-tricarboxylic acid anhydride

(3Z,5E)-octa-3,5-diene-1,3,4-tricarboxylic acid 3,4-anhydride|(3Z,5E)-Octa-3,5-diene-1,3,4-tricarboxylic acid anhydride

C11H12O5 (224.06847019999998)


   
   
   
   

azuleno[6,5-b]furan-5-carboxaldehyde, 3,8-dimethyl-

azuleno[6,5-b]furan-5-carboxaldehyde, 3,8-dimethyl-

C15H12O2 (224.0837252)


   

3,5-Dimethyl-4-methylenenaphtho[2,3-b]furan-9(4H)-one

3,5-Dimethyl-4-methylenenaphtho[2,3-b]furan-9(4H)-one

C15H12O2 (224.0837252)


   

1-(4-hydroxy-3,5-dimethoxy-phenyl)-propane-1,2-dione

1-(4-hydroxy-3,5-dimethoxy-phenyl)-propane-1,2-dione

C11H12O5 (224.06847019999998)


   

3-Acetyl-2-ethoxy-4,6-dihydroxybenzaldehyde

3-Acetyl-2-ethoxy-4,6-dihydroxybenzaldehyde

C11H12O5 (224.06847019999998)


   

Chalcone, 3

2-Propen-1-one, 3-(4-hydroxyphenyl)-1-phenyl-, (2E)-

C15H12O2 (224.0837252)


4-hydroxychalcone is a member of the class of chalcones that is trans-chalcone substituted by a hydroxy group at position 4. It has a role as a plant metabolite and an antihypertensive agent. It is a member of chalcones and a member of phenols. It is functionally related to a trans-chalcone. A member of the class of chalcones that is trans-chalcone substituted by a hydroxy group at position 4. 4-Hydroxychalcone is a chalcone metabolite with anti-angiogenic and anti-inflammatory activities. 4-Hydroxychalcone suppresses angiogenesis by suppression of growth factor pathway with no signs of cytotoxicity[1]. 4-Hydroxychalcone inhibits TNF-α induced NF-κB pathway activation and activates BMP signaling, reduces resistant hypertension (RH) by attenuating hyperaldosteronism and renal injury in mice[2].

   

Vasicine HCl

PYRROLO(2,1-B)QUINAZOLIN-3-OL, 1,2,3,9-TETRAHYDRO-, MONOHYDROCHLORIDE, (3S)-

C11H13ClN2O (224.0716358)


Vasicine hydrochloride (peganine hydrochloride) is a quinazoline alkaloid isolated from Justicia adhatoda. Vasicine (peganine) possesses anti- tuberculosis activity[1]. Vasicine hydrochloride (peganine hydrochloride) is a quinazoline alkaloid isolated from Justicia adhatoda. Vasicine (peganine) possesses anti- tuberculosis activity[1].

   

TOB-10

9H-Pyrido(3,4-b)indole, 1-ethenyl-4-methoxy-

C14H12N2O (224.09495819999998)


Dehydrocrenatine is a natural product found in Picrasma quassioides and Picrasma javanica with data available.

   

Spectrum5_000333

2-Propen-1-one, 1-(4-hydroxyphenyl)-3-phenyl-, (2E)-

C15H12O2 (224.0837252)


4-hydroxychalcone is a member of the class of chalcones that is trans-chalcone substituted by a hydroxy group at position 4. It has a role as an anti-inflammatory agent and an antineoplastic agent. It is a member of chalcones and a member of phenols. 4'-Hydroxychalcone is a chalcone isolated from licorice root, with hepatoprotective activity. 4'-Hydroxychalcone inhibits TNFα-induced NF-κB activation via proteasome inhibition. 4'-Hydroxychalcone induces a rapid potassium release from mitochondrial vesicles and causes deterioration of respiratory control and oxidative phosphorylation of isolated rat liver mitochondria[1][2][3].

   

Tox21_202901

InChI=1/C14H8O3/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7,15

C14H8O3 (224.0473418)


2-hydroxyanthraquinone is a monohydroxyanthraquinone. 2-Hydroxyanthraquinone is a natural product found in Primulina hedyotidea, Rubia tinctorum, and Galium odoratum with data available. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1]. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1].

   

3-Hydroxykynurenine

3-hydroxy-dl-kynurenine

C10H12N2O4 (224.07970319999998)


A hydroxykynurenine that is kynurenine substituted by a hydroxy group at position 3. C26170 - Protective Agent > C275 - Antioxidant MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; VCKPUUFAIGNJHC-UHFFFAOYSA-N_STSL_0007_3-Hydroxy-DL-Kynurenine_8000fmol_180416_S2_LC02_MS02_13; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I.

   

sinapic acid

Sinapinic acid

C11H12O5 (224.06847019999998)


Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3]. Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3].

   
   

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid

NCGC00169887-02!2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid

C11H12O5 (224.06847019999998)


   

4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydroisochromen-1-one

NCGC00380609-02!4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydroisochromen-1-one

C11H12O5 (224.06847019999998)


   

6,8-dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one

NCGC00385040-01!6,8-dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one

C11H12O5 (224.06847019999998)


   

4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydroisochromen-1-one

NCGC00380609-01!4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydroisochromen-1-one

C11H12O5 (224.06847019999998)


   

OCP_225.0789_16.6

4-(3-chlorophenyl)piperazine-1-carbaldehyde

C11H13ClN2O (224.0716358)


CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1304

   

O-Hydroxychalcone

O-Hydroxychalcone

C15H12O2 (224.0837252)


   
   

mevinphos

Pesticide1_Mevinphos Isomer 1*_C7H13O6P_2-Butenoic acid, 3-[(dimethoxyphosphinyl)oxy]-, methyl ester, (2E)-

C7H13O6P (224.0449728)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   
   

2-Hydroxychalcone

2-Propen-1-one,1-(2-hydroxyphenyl)-3-phenyl-, (2E)-

C15H12O2 (224.0837252)


2-hydroxychalcone, a natural flavonoid, is a potent antioxidant, inhibiting lipid peroxidation. 2-Hydroxychalcone induces apoptosis by Bcl-2 downregulation. 2-Hydroxychalcone inhibits the activation of NF-kB[1][2][3]. 2-hydroxychalcone, a natural flavonoid, is a potent antioxidant, inhibiting lipid peroxidation. 2-Hydroxychalcone induces apoptosis by Bcl-2 downregulation. 2-Hydroxychalcone inhibits the activation of NF-kB[1][2][3].

   

Stavudine

Stavudine

C10H12N2O4 (224.07970319999998)


J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AF - Nucleoside and nucleotide reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97452 - Nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents D009676 - Noxae > D000963 - Antimetabolites > D015224 - Dideoxynucleosides D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2238; ORIGINAL_PRECURSOR_SCAN_NO 2235 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2232; ORIGINAL_PRECURSOR_SCAN_NO 2230 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2236; ORIGINAL_PRECURSOR_SCAN_NO 2234 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2225; ORIGINAL_PRECURSOR_SCAN_NO 2224 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2291; ORIGINAL_PRECURSOR_SCAN_NO 2290 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2235; ORIGINAL_PRECURSOR_SCAN_NO 2233 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9439; ORIGINAL_PRECURSOR_SCAN_NO 9434 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9398; ORIGINAL_PRECURSOR_SCAN_NO 9395 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9567; ORIGINAL_PRECURSOR_SCAN_NO 9562 CONFIDENCE standard compound; INTERNAL_ID 1066; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9454; ORIGINAL_PRECURSOR_SCAN_NO 9450 Stavudine (d4T) is an orally active nucleoside reverse transcriptase inhibitor (NRTI). Stavudine has activity against HIV-1 and HIV-2. Stavudine also inhibits the replication of mitochondrial DNA (mtDNA). Stavudine reduces NLRP3 inflammasome activation and modulates Amyloid-β autophagy. Stavudine induces apoptosis[1][2][3][4].

   

1-Hydroxyanthraquinone

1-Hydroxyanthraquinone

C14H8O3 (224.0473418)


   

(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid

(4S,5Z,6S)-4-(2-methoxy-2-oxoethyl)-5-[2-[(E)-3-phenylprop-2-enoyl]oxyethylidene]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid

C15H12O2 (224.0837252)


   
   

4-Hydroxychalcone

4-Hydroxychalcone

C15H12O2 (224.0837252)


   

tubermycin B

phenazine-1-carboxylic acid

C13H8N2O2 (224.0585748)


Origin: Microbe; SubCategory_DNP: Isoquinoline alkaloids, Benzylisoquinoline alkaloids Phenazine-1-carboxylic acid exhibits strong antifungal activity against phytopathogenic fungi.

   

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid [IIN-based: Match]

NCGC00169887-02!2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid [IIN-based: Match]

C11H12O5 (224.06847019999998)


   

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid [IIN-based on: CCMSLIB00000845767]

NCGC00169887-02!2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid [IIN-based on: CCMSLIB00000845767]

C11H12O5 (224.06847019999998)


   
   
   
   
   

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid_major

2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid_major

C11H12O5 (224.06847019999998)


   
   

1-hydroxyanthraquinone_major

1-hydroxyanthraquinone_major

C14H8O3 (224.0473418)


   

Sinapinic acid

Sinapinic acid

C11H12O5 (224.06847019999998)


Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3]. Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3].

   

7-HYDROXYETHYLTHEOPHYLLINE

7-HYDROXYETHYLTHEOPHYLLINE

C9H12N4O3 (224.0909362)


   

Temurin

1,3,7,9-Tetramethyl-7,9-dihydro-1H-purine-2,6,8(3H)-trione

C9H12N4O3 (224.0909362)


   
   

L-Nicotianine

1-(3-amino-3-carboxypropyl)pyridin-1-ium-3-carboxylate

C10H12N2O4 (224.07970319999998)


   

N-Methoxy-1-vinyl-b-carboline

1-ethenyl-9-methoxy-9H-pyrido[3,4-b]indole

C14H12N2O (224.09495819999998)


   

6-Ethyl-4,5,7-trithiadecane

1-(propyldisulfanyl)-1-(propylsulfanyl)propane

C9H20S3 (224.07270800000003)


   

cis-Sinapic acid

(2Z)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid

C11H12O5 (224.06847019999998)


A 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid in which the double bond has cis-configuration. It has been isolated from the shoots of alfalfa. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   

5-[(3,4,5-trihydroxyphenyl)methyl]oxolan-2-one

5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone

C11H12O5 (224.06847019999998)


   

aurantoic acid

11-chloro-dodeca-2E,4E,6E,8E,10Z-pentaenoic acid

C12H13O2Cl (224.06040280000002)


   

FA 11:5;O3

3-(5-(2-carboxyethyl)-4-methylfuran-2-yl)-2E-propenoic acid

C11H12O5 (224.06847019999998)


   

methyl 3-(ethylamino)-4-nitrobenzoate

methyl 3-(ethylamino)-4-nitrobenzoate

C10H12N2O4 (224.07970319999998)


   

6-Chloro-2,3-dihydro-1H-indene-1-carboxylic acid ethyl ester

6-Chloro-2,3-dihydro-1H-indene-1-carboxylic acid ethyl ester

C12H13ClO2 (224.06040280000002)


   

5-Fluoro-2-(phenylethynyl)benzaldehyde

5-Fluoro-2-(phenylethynyl)benzaldehyde

C15H9FO (224.06373959999996)


   

9-fluorenyl acetate

9-fluorenyl acetate

C15H12O2 (224.0837252)


   

3-Butyn-2-yl 4-methylbenzenesulfonate

3-Butyn-2-yl 4-methylbenzenesulfonate

C11H12O3S (224.0507122)


   
   

3-(2-HYDROXY-4-METHOXY-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER

3-(2-HYDROXY-4-METHOXY-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER

C11H12O5 (224.06847019999998)


   

2-CHLORO-4-METHYLPHENYLHYDRAZINEHYDROCHLORIDE

2-CHLORO-4-METHYLPHENYLHYDRAZINEHYDROCHLORIDE

C11H12O5 (224.06847019999998)


   

2-(2-formyl-6-methoxyphenoxy)propanoic acid

2-(2-formyl-6-methoxyphenoxy)propanoic acid

C11H12O5 (224.06847019999998)


   

(4-Methoxybenzyl)hydrazine dihydrochloride

(4-Methoxybenzyl)hydrazine dihydrochloride

C8H14Cl2N2O (224.04831339999998)


   

[3-(1H-benzimidazol-2-yl)phenyl]methanol

[3-(1H-benzimidazol-2-yl)phenyl]methanol

C14H12N2O (224.09495819999998)


   

3-METHOXYBENZYLHYDRAZINE DIHYDROCHLORIDE

3-METHOXYBENZYLHYDRAZINE DIHYDROCHLORIDE

C8H14Cl2N2O (224.04831339999998)


   

Ethyl [4-(methylsulfanyl)phenyl](oxo)acetate

Ethyl [4-(methylsulfanyl)phenyl](oxo)acetate

C11H12O3S (224.0507122)


   

2-(4-PHENYLPHENYL)MALONDIALDEHYDE

2-(4-PHENYLPHENYL)MALONDIALDEHYDE

C15H12O2 (224.0837252)


   
   
   
   

Diethyl 2,2-difluoropentanedioate

Diethyl 2,2-difluoropentanedioate

C9H14F2O4 (224.0860108)


   

6-(BENZYLOXY)-1H-PYRROLO[2,3-B]PYRIDINE

6-(BENZYLOXY)-1H-PYRROLO[2,3-B]PYRIDINE

C14H12N2O (224.09495819999998)


   
   

N1-HEXADECYL-1,3-PROPANEDIAMINE

N1-HEXADECYL-1,3-PROPANEDIAMINE

C7H13ClN2O4 (224.0563808)


   

ethyl 2-diethoxyphosphorylacetate

ethyl 2-diethoxyphosphorylacetate

C8H17O5P (224.0813562)


   

2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]acetic acid

2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]acetic acid

C10H9FN2O3 (224.05971759999997)


   

2-(3-cyanophenyl)pyridine-3-carboxylic acid

2-(3-cyanophenyl)pyridine-3-carboxylic acid

C13H8N2O2 (224.0585748)


   

4-Methoxymethyl-2,3,5,6-tetrafluorobenzyl alcohol

4-Methoxymethyl-2,3,5,6-tetrafluorobenzyl alcohol

C9H8F4O2 (224.0460396)


   
   

4,6-DIAMINO-1,3-BENZENEDICARBOXYLIC ACID DIMETHYL ESTER

4,6-DIAMINO-1,3-BENZENEDICARBOXYLIC ACID DIMETHYL ESTER

C10H12N2O4 (224.07970319999998)


   

n-benzyloxycarbonylglycine thioamide

n-benzyloxycarbonylglycine thioamide

C10H12N2O2S (224.0619452)


   

(4-(Ethoxycarbonyl)-3-methoxyphenyl)boronic acid

(4-(Ethoxycarbonyl)-3-methoxyphenyl)boronic acid

C10H13BO5 (224.0855998)


   

2-azido-3-methylimidazo[4,5-f]quinoline

2-azido-3-methylimidazo[4,5-f]quinoline

C11H8N6 (224.08104079999998)


   

2-triethoxysilylethanethiol

2-triethoxysilylethanethiol

C8H20O3SSi (224.090237)


   
   

methyl 2-formyl-3,5-dimethoxybenzoate

methyl 2-formyl-3,5-dimethoxybenzoate

C11H12O5 (224.06847019999998)


   

1-(3-CYCLOHEXYLPROPYL)-PIPERAZINE

1-(3-CYCLOHEXYLPROPYL)-PIPERAZINE

C10H12N2O2S (224.0619452)


   

3-(4-METHYLTHIOBEZOYL)PROPIONIC ACID

3-(4-METHYLTHIOBEZOYL)PROPIONIC ACID

C11H12O3S (224.0507122)


   

6-(3-CYANOPHENYL)NICOTINIC ACID

6-(3-CYANOPHENYL)NICOTINIC ACID

C13H8N2O2 (224.0585748)


   

(Z)-alpha-Phenylcinnamic acid

Benzeneacetic acid, a-(phenylmethylene)-, (aZ)-

C15H12O2 (224.0837252)


   

DIETHYLPHOSPHONOBUTANOIC ACID

DIETHYLPHOSPHONOBUTANOIC ACID

C8H17O5P (224.0813562)


   
   

1-(4-Chlorophenyl)cyclopentanecarboxylic acid

1-(4-Chlorophenyl)cyclopentanecarboxylic acid

C12H13ClO2 (224.06040280000002)


   

TRIETHYL PHOSPHONOACETATE

TRIETHYL PHOSPHONOACETATE

C8H17O5P (224.0813562)


   

hydroxybenzalaceto-phenone

hydroxybenzalaceto-phenone

C15H12O2 (224.0837252)


   

Benzoic acid,4-[(aminothioxomethyl)amino]-, ethyl ester

Benzoic acid,4-[(aminothioxomethyl)amino]-, ethyl ester

C10H12N2O2S (224.0619452)


   

1-(4-CHLOROPHENYL)-5-PROPYL-1H-PYRAZOLE-4-CARBONYLCHLORIDE

1-(4-CHLOROPHENYL)-5-PROPYL-1H-PYRAZOLE-4-CARBONYLCHLORIDE

C12H13ClO2 (224.06040280000002)


   

(2E)-1-(4-aminophenyl)-3-pyridin-3-ylprop-2-en-1-one

(2E)-1-(4-aminophenyl)-3-pyridin-3-ylprop-2-en-1-one

C14H12N2O (224.09495819999998)


   

Benzenamine,4-(5-methyl-2-benzoxazolyl)-

Benzenamine,4-(5-methyl-2-benzoxazolyl)-

C14H12N2O (224.09495819999998)


   

4-NITRO-[1,1-BIPHENYL]-3-CARBONITRILE

4-NITRO-[1,1-BIPHENYL]-3-CARBONITRILE

C13H8N2O2 (224.0585748)


   

methyl 4-(ethylamino)-3-nitrobenzoate

methyl 4-(ethylamino)-3-nitrobenzoate

C10H12N2O4 (224.07970319999998)


   

5-(benzyloxy)-1H-pyrrolo[3,2-b]pyridine

5-(benzyloxy)-1H-pyrrolo[3,2-b]pyridine

C14H12N2O (224.09495819999998)


   

3-benzylphthalide

3-benzylphthalide

C15H12O2 (224.0837252)


   

Methyl 4-(4-fluorophenyl)-2,4-dioxobutanoate

Methyl 4-(4-fluorophenyl)-2,4-dioxobutanoate

C11H9FO4 (224.04848459999997)


   

ETHYL 4-(2-FLUOROPHENYL)-4-OXOBUTYRATE

ETHYL 4-(2-FLUOROPHENYL)-4-OXOBUTYRATE

C12H13FO3 (224.084868)


   

1,2-Propylene glycol, phthalic anhydride polymer

1,2-Propylene glycol, phthalic anhydride polymer

C11H12O5 (224.06847019999998)


   

9-Fluoreneacetic acid

9-Fluorene acetic acid

C15H12O2 (224.0837252)


   

2-(1,3-benzodioxol-5-yloxy)propanehydrazide

2-(1,3-benzodioxol-5-yloxy)propanehydrazide

C10H12N2O4 (224.07970319999998)


   

4-Cyano-2-nitrodiphenyl

4-Cyano-2-nitrodiphenyl

C13H8N2O2 (224.0585748)


   

3-NITRO-2-(PHENYLETHYNYL)PYRIDINE

3-NITRO-2-(PHENYLETHYNYL)PYRIDINE

C13H8N2O2 (224.0585748)


   

tert-Butyl O,O-dimethylphosphonoacetate

tert-Butyl O,O-dimethylphosphonoacetate

C8H17O5P (224.0813562)


   

(4,6-DIMETHYL-2,5-DIOXO-HEXAHYDRO-IMIDAZO-[4,5-D]IMIDAZOL-1-YL)-ACETICACID

(4,6-DIMETHYL-2,5-DIOXO-HEXAHYDRO-IMIDAZO-[4,5-D]IMIDAZOL-1-YL)-ACETICACID

C11H12O5 (224.06847019999998)


   

5-(4-CYANOPHENYL)NICOTINIC ACID

5-(4-CYANOPHENYL)NICOTINIC ACID

C13H8N2O2 (224.0585748)


   

5-FLUORO-7,8-DIMETHOXY-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

5-FLUORO-7,8-DIMETHOXY-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

C12H13FO3 (224.084868)


   

2-CHLORO-1-(2-ETHOXYETHYL)-1H-BENZO[D]IMIDAZOLE

2-CHLORO-1-(2-ETHOXYETHYL)-1H-BENZO[D]IMIDAZOLE

C11H13ClN2O (224.0716358)


   
   
   

N-Methyl-3-phenyl-5-isoxazolemethanamine hydrochloride

N-Methyl-3-phenyl-5-isoxazolemethanamine hydrochloride

C11H13ClN2O (224.0716358)


   

3-(trimethylsiloxypropyl)dimethylchlorosilane

3-(trimethylsiloxypropyl)dimethylchlorosilane

C8H21ClOSi2 (224.0819406)


   

2,5-dipyridin-4-yl-1,3,4-oxadiazole

2,5-dipyridin-4-yl-1,3,4-oxadiazole

C12H8N4O (224.06980779999998)


   

3-Acetylbenzophenone

3-Acetylbenzophenone

C15H12O2 (224.0837252)


   

4-phenylcinnamic acid

4-phenylcinnamic acid

C15H12O2 (224.0837252)


   

benzotriazol-1-yl(pyridin-4-yl)methanone

benzotriazol-1-yl(pyridin-4-yl)methanone

C12H8N4O (224.06980779999998)


   

9-Oxo-9H-fluorene-1-carboxylic acid

9-Oxo-9H-fluorene-1-carboxylic acid

C14H8O3 (224.0473418)


   

3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-THIOCHROMEN-4-ONE

3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-THIOCHROMEN-4-ONE

C11H12O3S (224.0507122)


   
   

ethyl beta-d-thioglucoside

ethyl beta-d-thioglucoside

C8H16O5S (224.0718406)


   

1(3H)-Isobenzofuranone,4,5,6-trimethoxy-

1(3H)-Isobenzofuranone,4,5,6-trimethoxy-

C11H12O5 (224.06847019999998)


   

2-(4-FLUOROBENZYL)-3-OXO-BUTYRICACIDMETHYLESTER

2-(4-FLUOROBENZYL)-3-OXO-BUTYRICACIDMETHYLESTER

C12H13FO3 (224.084868)


   

2-[(3-nitrobenzoyl)amino]acetate

2-[(3-nitrobenzoyl)amino]acetate

C9H8N2O5 (224.0433198)


   

phenyl-(3-phenyloxiran-2-yl)methanone

phenyl-(3-phenyloxiran-2-yl)methanone

C15H12O2 (224.0837252)


   

5-Chloro-3-((trimethylsilyl)ethynyl)pyridin-2-amine

5-Chloro-3-((trimethylsilyl)ethynyl)pyridin-2-amine

C10H13ClN2Si (224.05364880000002)


   

2-Chloro-3-((trimethylsilyl)ethynyl)pyridin-4-amine

2-Chloro-3-((trimethylsilyl)ethynyl)pyridin-4-amine

C10H13ClN2Si (224.05364880000002)


   

(S)-(-)-3-(Benzoylthio)-2-methylpropanoic acid

(S)-(-)-3-(Benzoylthio)-2-methylpropanoic acid

C11H12O3S (224.0507122)


   

1,10-Phenanthroline-4-carboxylic acid

1,10-Phenanthroline-4-carboxylic acid

C13H8N2O2 (224.0585748)


   
   
   

N-(4-Nitrophenyl)-2-hydroxy-2-methylpropanamide

N-(4-Nitrophenyl)-2-hydroxy-2-methylpropanamide

C10H12N2O4 (224.07970319999998)


   

4-oxobenzo[h]chromene-3-carbaldehyde

4-oxobenzo[h]chromene-3-carbaldehyde

C14H8O3 (224.0473418)


   

4-HYDROXY-5-METHYL-ISOPHTHALIC ACID DIMETHYL ESTER

4-HYDROXY-5-METHYL-ISOPHTHALIC ACID DIMETHYL ESTER

C11H12O5 (224.06847019999998)


   

6-(1,1-DIMETHOXYETHYL)-2-MERCAPTONICOTINONITRILE

6-(1,1-DIMETHOXYETHYL)-2-MERCAPTONICOTINONITRILE

C10H12N2O2S (224.0619452)


   

2-Acetamido-5-nitrobenzoic acid

2-Acetamido-5-nitrobenzoic acid

C9H8N2O5 (224.0433198)


   

5,7-Dimethyl-2,3-dihydro-1H-[1,4]diazepine perchlorate

5,7-Dimethyl-2,3-dihydro-1H-[1,4]diazepine perchlorate

C7H13ClN2O4 (224.0563808)


   

5-AMINOMETHYL-1H-PYRIDIN-2-ONE

5-AMINOMETHYL-1H-PYRIDIN-2-ONE

C12H13FO3 (224.084868)


   

2-chloro-5-(piperidin-1-ylcarbonyl)pyridine

2-chloro-5-(piperidin-1-ylcarbonyl)pyridine

C11H13ClN2O (224.0716358)


   

4-(4-FLUOROPHENYL)TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID

4-(4-FLUOROPHENYL)TETRAHYDRO-2H-PYRAN-4-CARBOXYLIC ACID

C12H13FO3 (224.084868)


   
   

1-CHLORO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZENE

1-CHLORO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZENE

C11H14BClO2 (224.07753240000002)


   
   

Acetic acid,2-[[4-(1,1-dimethylethyl)phenyl]thio]-

Acetic acid,2-[[4-(1,1-dimethylethyl)phenyl]thio]-

C12H16O2S (224.0870956)


   

2(R)-ACETYLTHIO-BENZENEPROPANOIC ACID

2(R)-ACETYLTHIO-BENZENEPROPANOIC ACID

C11H12O3S (224.0507122)


   

Methyl 4-(2-fluorophenyl)-2,4-dioxobutanoate

Methyl 4-(2-fluorophenyl)-2,4-dioxobutanoate

C11H9FO4 (224.04848459999997)


   

7-(BENZYLOXY)-1H-PYRROLO[3,2-B]PYRIDINE

7-(BENZYLOXY)-1H-PYRROLO[3,2-B]PYRIDINE

C14H12N2O (224.09495819999998)


   

4-(Benzyloxy)-1H-pyrrolo[2,3-b]pyridine

4-(Benzyloxy)-1H-pyrrolo[2,3-b]pyridine

C14H12N2O (224.09495819999998)


   

1H-Pyrazolo[4,3-d]pyrimidine-3-carboxylic acid, 4,5,6,7-tetrahydro-5,7-dioxo-, ethyl ester

1H-Pyrazolo[4,3-d]pyrimidine-3-carboxylic acid, 4,5,6,7-tetrahydro-5,7-dioxo-, ethyl ester

C8H8N4O4 (224.05455279999998)


   

methyl 3-carbamoyl-5-nitrobenzoate

methyl 3-carbamoyl-5-nitrobenzoate

C9H8N2O5 (224.0433198)


   

2-HYDROXY-10,11-DIHYDRO-5H-DIBENZO[A,D][7]ANNULEN-5-ONE

2-HYDROXY-10,11-DIHYDRO-5H-DIBENZO[A,D][7]ANNULEN-5-ONE

C15H12O2 (224.0837252)


   

3-(METHYLCARBAMOYL)-5-NITROPHENYLBORONIC ACID

3-(METHYLCARBAMOYL)-5-NITROPHENYLBORONIC ACID

C8H9BN2O5 (224.06044939999998)


   

1-Ethyl-3-Methylimidazolium Trifluoroacetate

1-Ethyl-3-Methylimidazolium Trifluoroacetate

C8H11F3N2O2 (224.0772582)


   

DIETHYL ((1,3-DIOXOLAN-2-YL)METHYL)PHOSPHONATE

DIETHYL ((1,3-DIOXOLAN-2-YL)METHYL)PHOSPHONATE

C8H17O5P (224.0813562)


   

Acetaldehyde,2-(2,4-dinitrophenyl)hydrazone

Acetaldehyde,2-(2,4-dinitrophenyl)hydrazone

C8H8N4O4 (224.05455279999998)


   

Benzene,1,2,3,4-tetramethyl-5,6-dinitro-

Benzene,1,2,3,4-tetramethyl-5,6-dinitro-

C10H12N2O4 (224.07970319999998)


   

1,3,5-Triazine-2,4,6-triamine phosphate

1,3,5-Triazine-2,4,6-triamine phosphate

C3H9N6O4P (224.0422884)


   

4-CYANO-4-NITRODIPHENYL

4-CYANO-4-NITRODIPHENYL

C13H8N2O2 (224.0585748)


   

4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid

4-(2-Ethoxy-2-oxoethoxy)benzeneboronic acid

C10H13BO5 (224.0855998)


   

2-(PHOSPHONOMETHYL)-PENTANEDIOIC ACID

2-(PHOSPHONOMETHYL)-PENTANEDIOIC ACID

C6H13N2O5P (224.0562058)


   

3-(Benzoylthio)-2-methylpropanoic acid

3-(Benzoylthio)-2-methylpropanoic acid

C11H12O3S (224.0507122)


   

2-[2-(trifluoromethyl)-1H-indol-3-yl]acetonitrile

2-[2-(trifluoromethyl)-1H-indol-3-yl]acetonitrile

C11H7F3N2 (224.0561298)


   

methyl 2-[(3-amino-2-hydroxy-benzoyl)amino]acetate

methyl 2-[(3-amino-2-hydroxy-benzoyl)amino]acetate

C10H12N2O4 (224.07970319999998)


   

3,3-Diphenyl-2-propenoic acid

3,3-Diphenyl-2-propenoic acid

C15H12O2 (224.0837252)


   

(4-((CYCLOPROPYLMETHYL)SULFINYL)PHENYL)BORONIC ACID

(4-((CYCLOPROPYLMETHYL)SULFINYL)PHENYL)BORONIC ACID

C10H13BO3S (224.06784180000002)


   

ethyl-beta-d-thiogalactopyranoside

ethyl-beta-d-thiogalactopyranoside

C8H16O5S (224.0718406)


   

1-(3-CHLOROPHENYL)CYCLOPENTANECARBOXYLIC ACID

1-(3-CHLOROPHENYL)CYCLOPENTANECARBOXYLIC ACID

C12H13ClO2 (224.06040280000002)


   

6-Methoxy-2-phenylimidazo[1,2-a]pyridine

6-Methoxy-2-phenylimidazo[1,2-a]pyridine

C14H12N2O (224.09495819999998)


   

1-(2-Methoxyethyl)-2-pyrrolidinone

1-(2-Methoxyethyl)-2-pyrrolidinone

C14H12N2O (224.09495819999998)


   

4-(1-oxidopyridin-4-ylidene)pyridin-1-ium 1-oxide,hydrate

4-(1-oxidopyridin-4-ylidene)pyridin-1-ium 1-oxide,hydrate

C10H12N2O4 (224.07970319999998)


   

1,10-Phenanthroline-5-carboxylic acid

1,10-Phenanthroline-5-carboxylic acid

C13H8N2O2 (224.0585748)


   

6-(3-Pyridinyl)-3,4-dihydro-2(1H)-quinolinone

6-(3-Pyridinyl)-3,4-dihydro-2(1H)-quinolinone

C14H12N2O (224.09495819999998)


   

3a-(Difluoromethyl)-2,3,3a,4-tetrahydro-1H-benzo[d]pyrrolo[1,2-a]imidazol-1-one

3a-(Difluoromethyl)-2,3,3a,4-tetrahydro-1H-benzo[d]pyrrolo[1,2-a]imidazol-1-one

C11H10F2N2O (224.0761154)


   

3-Acetao-2-nitrophenylboronic acid

3-Acetao-2-nitrophenylboronic acid

C8H9BN2O5 (224.06044939999998)


   

1,3-diphenyl-2,3-epoxy-1-propanone

1,3-diphenyl-2,3-epoxy-1-propanone

C15H12O2 (224.0837252)


   

5-Acetamido-2-nitrophenylboronic acid

5-Acetamido-2-nitrophenylboronic acid

C8H9BN2O5 (224.06044939999998)


   

5-acetamido-2-nitrobenzoic acid

5-acetamido-2-nitrobenzoic acid

C9H8N2O5 (224.0433198)


   

N-METHYL-1-(5-PHENYLISOXAZOL-3-YL)METHANAMINE HYDROCHLORIDE

N-METHYL-1-(5-PHENYLISOXAZOL-3-YL)METHANAMINE HYDROCHLORIDE

C11H13ClN2O (224.0716358)


   

5-METHOXY-3-PHENYLBENZOFURAN

5-METHOXY-3-PHENYLBENZOFURAN

C15H12O2 (224.0837252)


   

5-amino-2-methyl-10h-acridin-9-one

5-amino-2-methyl-10h-acridin-9-one

C14H12N2O (224.09495819999998)


   

1,2-Ethanedione,1,2-diphenyl-, 1-hydrazone

1,2-Ethanedione,1,2-diphenyl-, 1-hydrazone

C14H12N2O (224.09495819999998)


   

N-ETHOXYCARBONYL-5-NITRO-O-TOLUIDINE

N-ETHOXYCARBONYL-5-NITRO-O-TOLUIDINE

C10H12N2O4 (224.07970319999998)


   

(3-(2-Ethoxy-2-oxoethoxy)phenyl)boronic acid

(3-(2-Ethoxy-2-oxoethoxy)phenyl)boronic acid

C10H13BO5 (224.0855998)


   

(5-(Ethoxycarbonyl)-2-methoxyphenyl)boronic acid

(5-(Ethoxycarbonyl)-2-methoxyphenyl)boronic acid

C10H13BO5 (224.0855998)


   

(E)-3-(Methoxycarbonyl)-4-(5-methylfuran-2-yl)but-3-enoic acid

(E)-3-(Methoxycarbonyl)-4-(5-methylfuran-2-yl)but-3-enoic acid

C11H12O5 (224.06847019999998)


   

3-acetamido-2-nitro-benzoic acid

3-acetamido-2-nitro-benzoic acid

C9H8N2O5 (224.0433198)


   

methyl (4-formyl-2-methoxyphenoxy)acetate

methyl (4-formyl-2-methoxyphenoxy)acetate

C11H12O5 (224.06847019999998)


   

5-Benzooxazol-2-yl-2-methyl-phenylamine

5-Benzooxazol-2-yl-2-methyl-phenylamine

C14H12N2O (224.09495819999998)


   

1-(3-METHOXYBIPHENYL-4-YL)ETHANONE

1-(3-METHOXYBIPHENYL-4-YL)ETHANONE

C14H12N2O (224.09495819999998)


   

1,2,3,6-TETRAHYDROINDOLIZINO[6,7-B]INDOL-5-ONE

1,2,3,6-TETRAHYDROINDOLIZINO[6,7-B]INDOL-5-ONE

C14H12N2O (224.09495819999998)


   

2,2,2-Trifluoro-N-(2-oxa-6-azaspiro[3.4]oct-8-yl)acetamide

2,2,2-Trifluoro-N-(2-oxa-6-azaspiro[3.4]oct-8-yl)acetamide

C8H11F3N2O2 (224.0772582)


   

2-(PROPYLTHIO)BENZO[D]THIAZOL-6-AMINE

2-(PROPYLTHIO)BENZO[D]THIAZOL-6-AMINE

C10H12N2S2 (224.04418719999998)


   

sodium,1,1,2,2,3,3-hexadeuterio-3-trimethylsilylpropane-1-sulfonate

sodium,1,1,2,2,3,3-hexadeuterio-3-trimethylsilylpropane-1-sulfonate

C6H9D6NaO3SSi (224.07854706799998)


   

3-([1,1-BIPHENYL]-3-YL)ACRYLIC ACID

3-([1,1-BIPHENYL]-3-YL)ACRYLIC ACID

C15H12O2 (224.0837252)


   

2,2,2-TRIFLUORO-1-NAPHTHALEN-2-YL-ETHANONE

2,2,2-TRIFLUORO-1-NAPHTHALEN-2-YL-ETHANONE

C12H7F3O (224.0448968)


   

3,6-DIMETHYLIMIDAZO[2,1-B]THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER

3,6-DIMETHYLIMIDAZO[2,1-B]THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER

C10H12N2O2S (224.0619452)


   

8-(Benzyloxy)imidazo[1,5-a]pyridine

8-(Benzyloxy)imidazo[1,5-a]pyridine

C14H12N2O (224.09495819999998)


   

Dibenz(c,e)oxepin-5,7-dione

Dibenz(c,e)oxepin-5,7-dione

C14H8O3 (224.0473418)


   

(S)-6-METHOXY-2,5,7,8-TETRAMETHYLCHROMANE-2-CARBOXYLICACID

(S)-6-METHOXY-2,5,7,8-TETRAMETHYLCHROMANE-2-CARBOXYLICACID

C11H12O3S (224.0507122)


   

3-amino-4-methoxybenzene-methanamine dihydrochloride

3-amino-4-methoxybenzene-methanamine dihydrochloride

C8H14Cl2N2O (224.04831339999998)


   

4-NITRO-3-ACETYLAMINOBENZOIC ACID

4-NITRO-3-ACETYLAMINOBENZOIC ACID

C9H8N2O5 (224.0433198)


   

5-(AMINOMETHYL)-2-METHOXYANILINE DIHYDROCHLORIDE

5-(AMINOMETHYL)-2-METHOXYANILINE DIHYDROCHLORIDE

C8H14Cl2N2O (224.04831339999998)


   

3-(AMINOMETHYL)-4-METHOXYANILINE DIHYDROCHLORIDE

3-(AMINOMETHYL)-4-METHOXYANILINE DIHYDROCHLORIDE

C8H14Cl2N2O (224.04831339999998)


   

9-Oxo-9H-fluorene-4-carboxylic acid

9-Oxo-9H-fluorene-4-carboxylic acid

C14H8O3 (224.0473418)


   

(3-chloropropyl)pentamethyldisiloxane

(3-chloropropyl)pentamethyldisiloxane

C8H21ClOSi2 (224.0819406)


   

methyl 9H-fluorene-9-carboxylate

9H-Fluorene-9-carboxylicacid, methyl ester

C15H12O2 (224.0837252)


   

ethyl N-(4-methyl-3-nitrophenyl)carbamate

ethyl N-(4-methyl-3-nitrophenyl)carbamate

C10H12N2O4 (224.07970319999998)


   

1-(2-chloro-benzoyl)-piperazine

1-(2-chloro-benzoyl)-piperazine

C11H13ClN2O (224.0716358)


   

(3-CHLOROBENZYL)PHOSPHONICACIDDIETHYLESTER

(3-CHLOROBENZYL)PHOSPHONICACIDDIETHYLESTER

C11H13ClN2O (224.0716358)


   

4-(Trifluoromethyl)-1-naphthaldehyde

4-(Trifluoromethyl)-1-naphthaldehyde

C12H7F3O (224.0448968)


   
   

3-Acetamido-5-nitrobenzoic acid

3-Acetamido-5-nitrobenzoic acid

C9H8N2O5 (224.0433198)


   

N-ETHOXYCARBONYL-3-NITRO-O-TOLUIDINE

N-ETHOXYCARBONYL-3-NITRO-O-TOLUIDINE

C10H12N2O4 (224.07970319999998)


   

3-Cyano-N-propylbenzenesulfonamide

3-Cyano-N-propylbenzenesulfonamide

C10H12N2O2S (224.0619452)


   
   

3-Acetyl-biphenyl-3-carbaldehyde

3-Acetyl-biphenyl-3-carbaldehyde

C15H12O2 (224.0837252)


   
   

6-(4-CYANOPHENYL)PICOLINIC ACID

6-(4-CYANOPHENYL)PICOLINIC ACID

C13H8N2O2 (224.0585748)


   

5-(3-CYANOPHENYL)PICOLINIC ACID

5-(3-CYANOPHENYL)PICOLINIC ACID

C13H8N2O2 (224.0585748)


   

1,3-Benzenedicarboxylic acid, 5-(hydroxyMethyl)-, 1,3-dimethyl ester

1,3-Benzenedicarboxylic acid, 5-(hydroxyMethyl)-, 1,3-dimethyl ester

C11H12O5 (224.06847019999998)


   

dimethyl 5-hydroxy-3-methylbenzene-1,2-dicarboxylate

dimethyl 5-hydroxy-3-methylbenzene-1,2-dicarboxylate

C11H12O5 (224.06847019999998)


   

methyl 3-oxo-4-(phenylthio)butanoate

methyl 3-oxo-4-(phenylthio)butanoate

C11H12O3S (224.0507122)


   

azanium,2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate

azanium,2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate

C7H16N2O4S (224.0830736)


   

3-ETHYL-5-PYRAZOLCARBOXYLICACIDMETHYLESTER

3-ETHYL-5-PYRAZOLCARBOXYLICACIDMETHYLESTER

C9H18Cl2N2 (224.08469680000002)


   

Allyl(dichloro)hexylsilane

Allyl(dichloro)hexylsilane

C9H18Cl2Si (224.0554768)


   

(4-Carboxy-3-ethoxy)phenyl Acetic Acid

(4-Carboxy-3-ethoxy)phenyl Acetic Acid

C11H12O5 (224.06847019999998)


   

Pyridine,3,3-(1,3,4-oxadiazole-2,5-diyl)bis-

Pyridine,3,3-(1,3,4-oxadiazole-2,5-diyl)bis-

C12H8N4O (224.06980779999998)


   

4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide

C9H9ClN4O (224.0464854)


   

4-(3-Fluorophenyl)tetrahydro-2H-pyran-4-carboxylic acid

4-(3-Fluorophenyl)tetrahydro-2H-pyran-4-carboxylic acid

C12H13FO3 (224.084868)


   

4-(4-acetylphenyl)benzaldehyde

4-(4-acetylphenyl)benzaldehyde

C15H12O2 (224.0837252)


   

(4-CHLORO-PHENOXY)-ACETICACIDHYDRAZIDE

(4-CHLORO-PHENOXY)-ACETICACIDHYDRAZIDE

C11H13ClN2O (224.0716358)


   

dimethyl 4-methoxybenzene-1,2-dicarboxylate

dimethyl 4-methoxybenzene-1,2-dicarboxylate

C11H12O5 (224.06847019999998)


   

2-CHLORO-4-(1-PIPERIDINYLCARBONYL)PYRIDINE

2-CHLORO-4-(1-PIPERIDINYLCARBONYL)PYRIDINE

C11H13ClN2O (224.0716358)


   

3-(3-Ethylthioureido)phenylboronic acid

3-(3-Ethylthioureido)phenylboronic acid

C9H13BN2O2S (224.0790748)


   

4-(1,1,2,2-tetrafluoroethoxy)-3-benzenediamine

4-(1,1,2,2-tetrafluoroethoxy)-3-benzenediamine

C8H8F4N2O (224.05727259999998)


   
   

methyl 2-(2-oxopropylsulfanyl)benzoate

methyl 2-(2-oxopropylsulfanyl)benzoate

C11H12O3S (224.0507122)


   

Pyrimidine, 4-ethyl-2-(methylsulfonyl)-6-(1-propynyl)- (9CI)

Pyrimidine, 4-ethyl-2-(methylsulfonyl)-6-(1-propynyl)- (9CI)

C10H12N2O2S (224.0619452)


   

L-Asparagine tert.butyl ester hydrochloride

L-Asparagine tert.butyl ester hydrochloride

C8H17ClN2O3 (224.0927642)


   

S-Octyl chlorothioformate

S-Octyl chlorothioformate

C9H17ClS2 (224.0460152)


   

(R)-3-AMINO-4-(4-BROMOPHENYL)BUTANOICACIDHYDROCHLORIDE

(R)-3-AMINO-4-(4-BROMOPHENYL)BUTANOICACIDHYDROCHLORIDE

C10H12N2O4 (224.07970319999998)


   

propan-2-yl 5-amino-4-cyano-3-methylthiophene-2-carboxylate

propan-2-yl 5-amino-4-cyano-3-methylthiophene-2-carboxylate

C10H12N2O2S (224.0619452)


   

3-(6-methoxypyridin-3-yl)benzoic acid

3-(6-methoxypyridin-3-yl)benzoic acid

C13H8N2O2 (224.0585748)


   

3,4,6-trimethoxy-3H-2-benzofuran-1-one

3,4,6-trimethoxy-3H-2-benzofuran-1-one

C11H12O5 (224.06847019999998)


   

2-Methoxybenzylhydrazine dihydrochloride

2-Methoxybenzylhydrazine dihydrochloride

C8H14Cl2N2O (224.04831339999998)


   

alpha-Phenylcinnamic acid

Benzeneacetic acid, a-(phenylmethylene)-

C15H12O2 (224.0837252)


   
   
   

9-Oxo-9H-fluorene-2-carboxylic acid

9-Oxo-9H-fluorene-2-carboxylic acid

C14H8O3 (224.0473418)


   

2 4-BIS(DIMETHYLAMINO)-6-CHLOROPYRIDINE-3-CARBONITRILE

2 4-BIS(DIMETHYLAMINO)-6-CHLOROPYRIDINE-3-CARBONITRILE

C10H13ClN4 (224.0828688)


   

2-Fluoro-2-methyl-3-oxo-3-phenyl-propionic acid ethyl ester

2-Fluoro-2-methyl-3-oxo-3-phenyl-propionic acid ethyl ester

C12H13FO3 (224.084868)


   

o-Nitrobenzoylglycine

o-Nitrobenzoylglycine

C9H8N2O5 (224.0433198)


   

6-chloro-4-ethoxypyrido[3,2-d]pyrimidin-2-amine

6-chloro-4-ethoxypyrido[3,2-d]pyrimidin-2-amine

C9H9ClN4O (224.0464854)


   

3-P-TOLYLSULFANYL-PROPIONIC ACID ETHYL ESTER

3-P-TOLYLSULFANYL-PROPIONIC ACID ETHYL ESTER

C12H16O2S (224.0870956)


   

2-(3-methoxy-4-(methoxycarbonyl)phenyl)acetic acid

2-(3-methoxy-4-(methoxycarbonyl)phenyl)acetic acid

C11H12O5 (224.06847019999998)


   
   

2-Acetamido-6-nitrobenzoic acid

2-Acetamido-6-nitrobenzoic acid

C9H8N2O5 (224.0433198)


   

4-Acetoxy-3-methoxyphenylacetic acid

4-Acetoxy-3-methoxyphenylacetic acid

C11H12O5 (224.06847019999998)


   
   

2-hydroxyethyl D-glucoside

2-hydroxyethyl D-glucoside

C8H16O7 (224.0895986)


   
   

BENZENEPROPANOIC ACID, 3,4-DIMETHOXY-.ALPHA.-OXO-

BENZENEPROPANOIC ACID, 3,4-DIMETHOXY-.ALPHA.-OXO-

C11H12O5 (224.06847019999998)


   

4-Methoxybenzylhydrazine dihydrochloride

4-Methoxybenzylhydrazine dihydrochloride

C8H14Cl2N2O (224.04831339999998)


   

Ethyl 4-(3-fluorophenyl)-3-oxobutanoate

Ethyl 4-(3-fluorophenyl)-3-oxobutanoate

C12H13FO3 (224.084868)


   

1-(Methoxymethyl)-3-(trifluoromethyl)-1H-pyrazol-4-ylboronic acid

1-(Methoxymethyl)-3-(trifluoromethyl)-1H-pyrazol-4-ylboronic acid

C6H8BF3N2O3 (224.0580044)


   

4-[(2-NITROPHENYL)AMINO]BUTANOIC ACID

4-[(2-NITROPHENYL)AMINO]BUTANOIC ACID

C10H12N2O4 (224.07970319999998)


   

2-(4-Methoxyphenyl)succinic acid

2-(4-Methoxyphenyl)succinic acid

C11H12O5 (224.06847019999998)


   

4-NITROPHENYL AMINOETHYLUREA

4-NITROPHENYL AMINOETHYLUREA

C9H12N4O3 (224.0909362)


   

4-nitrohippuric acid

4-nitrohippuric acid

C9H8N2O5 (224.0433198)


   

1,3-dimethyl-5,8-dihydropteridine-2,4,6,7-tetrone

1,3-dimethyl-5,8-dihydropteridine-2,4,6,7-tetrone

C8H8N4O4 (224.05455279999998)


   

Benzoic acid,2-(acetylamino)-4-nitro-

Benzoic acid,2-(acetylamino)-4-nitro-

C9H8N2O5 (224.0433198)


   

2-CHLORO-3-(PIPERIDIN-1-YLCARBONYL)PYRIDINE

2-CHLORO-3-(PIPERIDIN-1-YLCARBONYL)PYRIDINE

C11H13ClN2O (224.0716358)


   

Melamine Polyphosphate

Melamine Polyphosphate

C3H9N6O4P (224.0422884)


   

9-FLUORENONE-1-BORONIC ACID

9-FLUORENONE-1-BORONIC ACID

C13H9BO3 (224.0644714)


   

2,3-DIHYDRO-6,7-DIMETHOXY-4H-1-BENZOTHIOPYRAN-4-ONE

2,3-DIHYDRO-6,7-DIMETHOXY-4H-1-BENZOTHIOPYRAN-4-ONE

C11H12O3S (224.0507122)


   

2-Amino-8-chloro-1,2,3,4-tetrahydro-2-naphthalenecarboxamide

2-Amino-8-chloro-1,2,3,4-tetrahydro-2-naphthalenecarboxamide

C11H13ClN2O (224.0716358)


   

1-NAPHTHYL TRIFLUOROMETHYL KETONE

1-NAPHTHYL TRIFLUOROMETHYL KETONE

C12H7F3O (224.0448968)


   

6-(Benzyloxy)-1-benzofuran

6-(Benzyloxy)-1-benzofuran

C15H12O2 (224.0837252)


   

3-[(methylamino)carbonyl]-5-nitrobenzoic acid

3-[(methylamino)carbonyl]-5-nitrobenzoic acid

C9H8N2O5 (224.0433198)


   

6-Benzothiazolamine,2-[(1-methylethyl)thio]-(9CI)

6-Benzothiazolamine,2-[(1-methylethyl)thio]-(9CI)

C10H12N2S2 (224.04418719999998)


   

Ethyl 4-(methylamino)-3-nitrobenzoate

Ethyl 4-(methylamino)-3-nitrobenzoate

C10H12N2O4 (224.07970319999998)


   

4-(Isopropylamino)-3-nitrobenzoic acid

4-(Isopropylamino)-3-nitrobenzoic acid

C10H12N2O4 (224.07970319999998)


   

2-Butynyl 4-methylbenzenesulfonate

2-Butynyl 4-methylbenzenesulfonate

C11H12O3S (224.0507122)


   

4-(2-chlorophenyl)oxane-4-carbaldehyde

4-(2-chlorophenyl)oxane-4-carbaldehyde

C12H13ClO2 (224.06040280000002)


   

4-(3-Chlorophenyl)tetrahydropyran-4-carboxaldehyde

4-(3-Chlorophenyl)tetrahydropyran-4-carboxaldehyde

C12H13ClO2 (224.06040280000002)


   

3-Acetamido-4-nitrophenylboronic acid

3-Acetamido-4-nitrophenylboronic acid

C8H9BN2O5 (224.06044939999998)


   

benzotriazol-1-yl(pyridin-2-yl)methanone

benzotriazol-1-yl(pyridin-2-yl)methanone

C12H8N4O (224.06980779999998)


   

TEREPHTHALIC ACID 2-HYDROXYETHYL METHYL ESTER

TEREPHTHALIC ACID 2-HYDROXYETHYL METHYL ESTER

C11H12O5 (224.06847019999998)


   

1,10-phenanthroline-2-carboxylic acid

1,10-phenanthroline-2-carboxylic acid

C13H8N2O2 (224.0585748)


   

N-(4-Methoxy-2-methyl-5-nitrophenyl)acetamide

N-(4-Methoxy-2-methyl-5-nitrophenyl)acetamide

C10H12N2O4 (224.07970319999998)


   

4-Acetamido-3-nitrobenzoic acid

4-Acetamido-3-nitrobenzoic acid

C9H8N2O5 (224.0433198)


   

(R)-2-Amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid

(R)-2-Amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid

C10H12N2O4 (224.07970319999998)


   

4-Amino-4-deoxychorismate(1-)

4-Amino-4-deoxychorismate(1-)

C10H10NO5- (224.05589500000002)


A dicarboxylic acid monoanion that is the conjugate base of 4-amino-4-deoxychorismic acid.

   

Phenylbenzylglyoxal

Phenylbenzylglyoxal

C15H12O2 (224.0837252)


   

2-Phenazinecarboxylic acid

2-Phenazinecarboxylic acid

C13H8N2O2 (224.0585748)


   

1-Oxido-2-(2-pyridinyl)-3-indol-1-iumone

1-Oxido-2-(2-pyridinyl)-3-indol-1-iumone

C13H8N2O2 (224.0585748)


   

(2R)-flavanone

(2R)-flavanone

C15H12O2 (224.0837252)


The (R)-enantiomer of flavanone.

   

3-Nitroso-2-phenylimidazo[1,2-a]pyrimidine

3-Nitroso-2-phenylimidazo[1,2-a]pyrimidine

C12H8N4O (224.06980779999998)


   

Methyl 2-amino-3-(4-nitrophenyl)propanoate

Methyl 2-amino-3-(4-nitrophenyl)propanoate

C10H12N2O4 (224.07970319999998)


   

N-(4,5-dihydro-1,3-thiazol-2-yl)-1-ethyl-1H-pyrazole-3-carboxamide

N-(4,5-dihydro-1,3-thiazol-2-yl)-1-ethyl-1H-pyrazole-3-carboxamide

C9H12N4OS (224.07317819999997)


   

Trimethylsilyl 4-methoxybenzoate

Trimethylsilyl 4-methoxybenzoate

C11H16O3Si (224.0868666)


   

m-Anisaldehyde, 4-(trimethylsiloxy)-

m-Anisaldehyde, 4-(trimethylsiloxy)-

C11H16O3Si (224.0868666)


   

Benzoic acid, 2-methoxy-, trimethylsilyl ester

Benzoic acid, 2-methoxy-, trimethylsilyl ester

C11H16O3Si (224.0868666)


   

Benzoic acid, p-(trimethylsiloxy)-, methyl ester

Benzoic acid, p-(trimethylsiloxy)-, methyl ester

C11H16O3Si (224.0868666)


   

Acetic acid, phenoxy-, trimethylsilyl ester

Acetic acid, phenoxy-, trimethylsilyl ester

C11H16O3Si (224.0868666)


   

Benzoic acid, 2-[(trimethylsilyl)oxy]-, methyl ester

Benzoic acid, 2-[(trimethylsilyl)oxy]-, methyl ester

C11H16O3Si (224.0868666)


   

Benzoic acid, m-(trimethylsiloxy)-, methyl ester

Benzoic acid, m-(trimethylsiloxy)-, methyl ester

C11H16O3Si (224.0868666)


   

Ethyl (3,5-dimethyl-4-methylthio)benzoate

Ethyl (3,5-dimethyl-4-methylthio)benzoate

C12H16O2S (224.0870956)


   

L-[(N-Hydroxyamino)carbonyl]phenylalanine

L-[(N-Hydroxyamino)carbonyl]phenylalanine

C10H12N2O4 (224.07970319999998)


   

(5R)-4-Hydroxy-3,5-dimethyl-5-[(1E,3E)-2-methylpenta-1,3-dienyl]thiophen-2(5H)-one

(5R)-4-Hydroxy-3,5-dimethyl-5-[(1E,3E)-2-methylpenta-1,3-dienyl]thiophen-2(5H)-one

C12H16O2S (224.0870956)


   

(S)-2-(Mercaptomethyl)-5-Phenylpentanoic Acid

(S)-2-(Mercaptomethyl)-5-Phenylpentanoic Acid

C12H16O2S (224.0870956)


   

d-[(n-Hydroxyamino)carbonyl]phenylalanine

d-[(n-Hydroxyamino)carbonyl]phenylalanine

C10H12N2O4 (224.07970319999998)


   

Karenzu DK2

1,3-di(phenyl)propane-1,3-dione

C15H12O2 (224.0837252)


Dibenzoylmethane, a minor ingredient in licorice, activates Nrf2 and prevents various cancers and oxidative damage. Dibenzoylmethane, an analog of curcumin, results in dissociation from Keap1 and nuclear translocation of Nrf2[1]. Dibenzoylmethane, a minor ingredient in licorice, activates Nrf2 and prevents various cancers and oxidative damage. Dibenzoylmethane, an analog of curcumin, results in dissociation from Keap1 and nuclear translocation of Nrf2[1].

   

AI3-00855

2-Propen-1-one,3-(2-hydroxyphenyl)-1-phenyl-, (2E)-

C15H12O2 (224.0837252)


2-hydroxychalcone, a natural flavonoid, is a potent antioxidant, inhibiting lipid peroxidation. 2-Hydroxychalcone induces apoptosis by Bcl-2 downregulation. 2-Hydroxychalcone inhibits the activation of NF-kB[1][2][3]. 2-hydroxychalcone, a natural flavonoid, is a potent antioxidant, inhibiting lipid peroxidation. 2-Hydroxychalcone induces apoptosis by Bcl-2 downregulation. 2-Hydroxychalcone inhibits the activation of NF-kB[1][2][3].

   

CHEBI:36105

(2R)-2-phenyl-2,3-dihydro-4H-chromen-4-one

C15H12O2 (224.0837252)


   

129-43-1

InChI=1\C14H8O3\c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16\h1-7,15

C14H8O3 (224.0473418)


D009676 - Noxae > D002273 - Carcinogens 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1]. 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1].

   

605-32-3

InChI=1\C14H8O3\c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16\h1-7,15

C14H8O3 (224.0473418)


2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1]. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1].

   

CHEBI:15606

(2S)-2-phenyl-2,3-dihydro-4H-chromen-4-one

C15H12O2 (224.0837252)


   

Ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate

Ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate

C11H12O5 (224.06847019999998)


   

(3As)-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide

8lambda6-thia-2,7-diazatricyclo[7.4.0.0^{2,6}]trideca-1(13),9,11-triene-8,8-dione

C10H12N2O2S (224.0619452)


   

3-Hydroxy-kynurenine

3-Hydroxy-kynurenine

C10H12N2O4 (224.07970319999998)


COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   
   
   
   

3-(Carboxymethylaminomethyl)-4-hydroxybenzoate

3-(Carboxymethylaminomethyl)-4-hydroxybenzoate

C10H10NO5- (224.05589500000002)


   

3-Chlorodiaminopimelate

3-Chlorodiaminopimelate

C7H13ClN2O4 (224.0563808)


   

(2S,3R)-4-(2-aminophenyl)-2-amino-3-hydroxy-4-oxobutanoate

(2S,3R)-4-(2-aminophenyl)-2-amino-3-hydroxy-4-oxobutanoate

C10H12N2O4 (224.07970319999998)


   

(2S,3R)-2-amino-4-(2-aminophenyl)-3-hydroxy-4-oxobutanoic acid

(2S,3R)-2-amino-4-(2-aminophenyl)-3-hydroxy-4-oxobutanoic acid

C10H12N2O4 (224.07970319999998)


   

(3S)-3-(1-carboxyethenoxy)cyclohepta-1,6-diene-1-carboxylic acid

(3S)-3-(1-carboxyethenoxy)cyclohepta-1,6-diene-1-carboxylic acid

C11H12O5 (224.06847019999998)


   

(2S,3R,6S)-2,6-diamino-3-chloroheptanedioic acid

(2S,3R,6S)-2,6-diamino-3-chloroheptanedioic acid

C7H13ClN2O4 (224.0563808)


   

(4R,5R,6S)-4,5,6,7,7-pentahydroxy-2-oxoheptanoic acid

(4R,5R,6S)-4,5,6,7,7-pentahydroxy-2-oxoheptanoic acid

C7H12O8 (224.0532152)


   

(6aS,11aS)-pterocarpan

(6aS,11aS)-pterocarpan

C15H12O2 (224.0837252)


   

(6aR,11aR)-pterocarpan

(6aR,11aR)-pterocarpan

C15H12O2 (224.0837252)


   

(3S)-isoflavanone

(3S)-isoflavanone

C15H12O2 (224.0837252)


   

3-(3-Hydroxy-4,5-dimethoxyphenyl)prop-2-enoic acid

3-(3-Hydroxy-4,5-dimethoxyphenyl)prop-2-enoic acid

C11H12O5 (224.06847019999998)


   

5-(3,4-Dihydroxyphenyl)-4-oxopentanoic acid

5-(3,4-Dihydroxyphenyl)-4-oxopentanoic acid

C11H12O5 (224.06847019999998)


   

5-hydroxy-L-kynurenine zwitterion

5-hydroxy-L-kynurenine zwitterion

C10H12N2O4 (224.07970319999998)


Tha amino acid zwitterion formed from 5-hydroxy-L-kynurenine by transfer of a proton from the carboxy to the amino group; principal microspecies at pH 7.3.

   

5-[(2,4,5-Trihydroxyphenyl)methyl]oxolan-2-one

5-[(2,4,5-Trihydroxyphenyl)methyl]oxolan-2-one

C11H12O5 (224.06847019999998)


   

3,4-dihydroxy-7-methylidene-2-[(E)-prop-1-enyl]-3,4-dihydro-2H-furo[3,4-b]pyran-5-one

3,4-dihydroxy-7-methylidene-2-[(E)-prop-1-enyl]-3,4-dihydro-2H-furo[3,4-b]pyran-5-one

C11H12O5 (224.06847019999998)


   

N-(2-hydroxy,5-methoxyphenyl)malonamate

N-(2-hydroxy,5-methoxyphenyl)malonamate

C10H10NO5- (224.05589500000002)


   

4-Methoxy-3-[(trimethylsilyl)oxy]benzaldehyde

4-Methoxy-3-[(trimethylsilyl)oxy]benzaldehyde

C11H16O3Si (224.0868666)


   

o-Vanillin, TMS derivative

o-Vanillin, TMS derivative

C11H16O3Si (224.0868666)


   

Trimethylsilyl 3-methoxybenzoate

Trimethylsilyl 3-methoxybenzoate

C11H16O3Si (224.0868666)


   

2-Hydroxy-5-methoxybenzaldehyde, TMS derivative

2-Hydroxy-5-methoxybenzaldehyde, TMS derivative

C11H16O3Si (224.0868666)


   

2-Hydroxy-4-methoxybenzaldehyde, TMS derivative

2-Hydroxy-4-methoxybenzaldehyde, TMS derivative

C11H16O3Si (224.0868666)


   

4-Hydroxy-2-methoxybenzaldehyde, TMS derivative

4-Hydroxy-2-methoxybenzaldehyde, TMS derivative

C11H16O3Si (224.0868666)


   

FLAVANONE (3,3-D2)

FLAVANONE (3,3-D2)

C15H12O2 (224.0837252)


   

(4S,5S)-2-(2-Chloroethyl)-4,5-bis(methoxymethyl)-1,3-dioxolane

(4S,5S)-2-(2-Chloroethyl)-4,5-bis(methoxymethyl)-1,3-dioxolane

C9H17ClO4 (224.0815312)


   

6,8-Dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one

6,8-Dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one

C11H12O5 (224.06847019999998)


   

(2S)-Flavanone

(2S)-Flavanone

C15H12O2 (224.0837252)


The (S)-enantiomer of flavanone.

   
   
   
   

Tetramethyluric acid

1,3,7,9-Tetramethyluric acid

C9H12N4O3 (224.0909362)


An oxopurine that is uric acid in which the hydrogens at positions 1,3,7 and 9 are replaced by methyl groups. It is a purine alkaloid that is found in Chinese tea known as kucha (Camellia assamica var. kucha) and exhibits anti-inflammatory and analgesic properties.

   

3-hydroxy-L-kynurenine zwitterion

3-hydroxy-L-kynurenine zwitterion

C10H12N2O4 (224.07970319999998)


Zwitterionic form of 3-hydroxy-L-kynurenine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3

   
   

5-Hydroxykynurenine

5-Hydroxykynurenine

C10H12N2O4 (224.07970319999998)


A hydroxykynurenine that is kynurenine bearing a hydroxy group at the position 5.

   

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone

5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone

C11H12O5 (224.06847019999998)


A butan-4-olide that is gamma-valerolactone in which one of the methyl hydrogens has been replaced by a 3,4,5-trihydroxyphenyl group.

   

Propyl 1-(propylthio)propyl disulfide

Propyl 1-(propylthio)propyl disulfide

C9H20S3 (224.07270800000003)


   

4-methyl-5-carboxyethyl-2-furanacrylic acid

4-methyl-5-carboxyethyl-2-furanacrylic acid

C11H12O5 (224.06847019999998)


   

5-Hydroxy-5-(4-hydroxyphenyl)-3-oxopentanoate

5-Hydroxy-5-(4-hydroxyphenyl)-3-oxopentanoate

C11H12O5 (224.06847019999998)


   
   

S 18986

S 18986

C10H12N2O2S (224.0619452)


S 18986 is a selective, orally active, brain penetrant positive allosteric modulator of AMPA-type receptors. S 18986 shows cognitive enhancing properties in rodents. S 18986 activates the release of noradrenaline and acetylcholine in rat hippocampus and enhances rat memory in object-recognition tests[1][2].