Exact Mass: 170.0423

3,4-Dihydroxyphenylglycol, also known as DHPG or DOPEG, belongs to the class of organic compounds known as catechols. Catechols are compounds containing a 1,2-benzenediol moiety. 3,4-Dihydroxyphenylglycol is an extremely weak basic (essentially neutral) compound. 3,4-Dihydroxyphenylglycol exists in all living organisms, ranging from bacteria to plants to humans. It is a potent antioxidant (PMID: 30007612). In mammals, 3,4-Dihydroxyphenylglycol is the primary metabolite of norepinephrine and is generated through the action of the enzyme monoamine oxidase (MAO). DHPG is then further metabolized by the enzyme Catechol-O-methyltransferase (COMT) to 3-methoxy-4-hydroxyphenylglycol (MHPG). Within humans, 3,4-dihydroxyphenylglycol participates in a number of enzymatic reactions. In particular, 3,4-dihydroxyphenylglycol can be biosynthesized from 3,4-dihydroxymandelaldehyde; which is mediated by the enzyme alcohol dehydrogenase 1A. In addition, 3,4-dihydroxyphenylglycol and guaiacol can be converted into vanylglycol and pyrocatechol through its interaction with the enzyme catechol O-methyltransferase. Outside of the human body, 3,4-dihydroxyphenylglycol is found, on average, in the highest concentration in olives. High levels of DHPG (up to 368 mg/kg of dry weight) have been found in the pulp of natural black olives. This could make 3,4-dihydroxyphenylglycol a potential biomarker for the consumption of olives and olive oil. 3,4-Dihydroxyphenylglycol has been linked to Menkes disease (PMID: 19234788). DHPG level are lower in Menkes patients (3.57 ¬± 0.40 nM) than healthy infants 8.91 ¬± 0.77 nM). Menkes disease (also called ‚Äúkinky hair disease‚Äù) is an X-linked recessive neurodevelopmental disorder caused by defects in a gene that encodes a copper-transporting ATPase (ATP7A). Affected infants typically appear healthy at birth and show normal neurodevelopment for 2-3 months. Subsequently there is loss of milestones (e.g., smiling, visual tracking, head control) and death in late infancy or childhood (PMID: 19234788). 3,4-Dihydroxyphenylglycol (DOPEG) is a normal norepinephrine metabolite present in CSF, plasma and urine in humans (PMID 6875564). In healthy individuals there is a tendency for free DOPEG to increase and for conjugated DOPEG to decrease with age; plasmatic DOPEG levels are significantly lower in depressed patients as compared to healthy controls (PMID 6671452). DL-1-(3,4-Dihydroxyphenyl)-1,2-ethanediol is found in olive. 4-(1,2-Dihydroxyethyl)benzene-1,2-diol, a normal norepinephrine metabolite, is found to be associated with Menkes syndrome.

Propylthiouracil

6-propyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

Propylthiouracil is only found in individuals that have used or taken this drug. It is a thiourea antithyroid agent. Propythiouracil inhibits the synthesis of thyroxine and inhibits the peripheral conversion of throxine to tri-iodothyronine. It is used in the treatment of hyperthyroidism. (From Martindale, The Extra Pharmacopeoia, 30th ed, p534)Propylthiouracil binds to thyroid peroxidase and thereby inhibits the conversion of iodide to iodine. Thyroid peroxidase normally converts iodide to iodine (via hydrogen peroxide as a cofactor) and also catalyzes the incorporation of the resulting iodide molecule onto both the 3 and/or 5 positions of the phenol rings of tyrosines found in thyroglobulin. Thyroglobulin is degraded to produce thyroxine (T4) and tri-iodothyronine (T3), which are the main hormones produced by the thyroid gland. Therefore propylthiouracil effectively inhibits the production of new thyroid hormones. H - Systemic hormonal preparations, excl. sex hormones and insulins > H03 - Thyroid therapy > H03B - Antithyroid preparations > H03BA - Thiouracils D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D013956 - Antithyroid Agents C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C885 - Antithyroid Agent D009676 - Noxae > D000963 - Antimetabolites KEIO_ID P055 Propylthiouracil (6-n-Propylthiouracil), a thioamide antithyroid agent, is an orally active thyroperoxidase and type-1 deiodinase (DIO1) inhibitor. Propylthiouracil can be used for the Graves disease and hyperthyroidism research[1].

penicillic acid

(2E)-3-methoxy-5-methyl-4-oxohexa-2,5-dienoic acid

D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE isolated standard

5-Ureido-4-imidazole carboxylate

5-ureidoimidazole-4-carboxylic acid

1,2-Dihydroxy-3-methylcyclohexa-3,5-dienecarboxylate

1,6-dihydroxy-5-methylcyclohexa-2,4-dienecarboxylic acid

1,6-Dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid

1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate

1,6-dihydroxy-2-methylcyclohexa-2,4-dienecarboxylic acid

2-Hydroxy-6-oxo-octa-2,4-dienoate

CID 53297380

C6H10MgO4 (170.043)

Propane,2,2-oxybis[1-chloro-

BIS(2-CHLORO-1-METHYLETHYL) ETHER

C6H12Cl2O (170.0265)

1H-indole-3-carbonyl cyanide

Herierin III

6-Methyl-2,5-dihydroxymethyl-gamma-pyranone III

Herierin III is found in mushrooms. Herierin III is a constituent of Hericium erinaceum (lions mane). Constituent of Hericium erinaceum (lions mane). Herierin III is found in mushrooms.

2,6-dimethoxybenzene-1,4-diol

Herierin IV

5-(1-Hydroxyethyl)-2-(hydroxymethyl)-(-)-4H-pyran-4-one

Herierin IV is found in mushrooms. Herierin IV is a constituent of Hericium erinaceum (lions mane). Constituent of Hericium erinaceum (lions mane). Herierin IV is found in mushrooms.

2,5-Dimethyl-3-furanthiol acetate

Ethanethioic acid, S-(2,5-dimethyl-3-furanyl) ester

2,5-Dimethyl-3-furanthiol acetate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

Furaneol acetate

2,5-Dimethyl-4-oxo-4,5-dihydrofuran-3-yl acetic acid

Furaneol acetate is used in meaty and caramel-type flavours. It is used in meaty and caramel-type flavours.

S-(2-Furanylmethyl) propanethioate

1-{[(furan-2-yl)methyl]sulphanyl}propan-1-one

S-(2-Furanylmethyl) propanethioate is a flavouring ingredient. Flavouring ingredient

3,4-Methyleneadipic acid

3,4-dimethylidenehexanedioic acid

3,4-Methyleneadipic acid belongs to the family of Branched Fatty Acids. These are fatty acids containing a branched chain.

1Propylthiouracil

1-propyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

Dihydroxyphenylethyleneglycol

1-phenylethane-1,2,2,2-tetrol

Ethylene glycol diacrylate

Poly(ethylene glycol)-diacrylate macromer

D013501 - Surface-Active Agents > D011092 - Polyethylene Glycols D001697 - Biomedical and Dental Materials

n-propylthiouracil

3-propyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidin-4-one

1,5-Dinitrocyclohexa-1,4-diene

1,6-Dinitrocyclohexa-1,4-diene

Penicillic acid

3-Methoxy-5-methyl-4-oxo-2,5-hexadienoic acid

Dihydrofumigatin

3-methoxy-6-methylbenzene-1,2,4-triol

Dihydrofumigatin is a member of the class of compounds known as ubiquinols. Ubiquinols are coenzyme Q derivatives containing a 5, 6-dimethoxy-3-methylbenzene-1,4-diol moiety to which an isoprenyl group is attached at ring position 2(or 6). Dihydrofumigatin is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Dihydrofumigatin can be found in ceylon cinnamon, which makes dihydrofumigatin a potential biomarker for the consumption of this food product.

(4Z,6R,7R)-5-(2,3-dihydroxybutylidene)furan-2(5H)-one|(4Z,6R,7R)-6,7-dihydroxyocta-2,4-dien-4-lactone|versicolactone A

SCHEMBL7643331

2-amino-4-chlorobenzamide

methyl 1-hydroxy-6-oxocyclohex-2-enecarboxylate

2,5-dimethoxybenzene-1,3-diol

coriloxin

3,4-Epoxy-5-hydroxycyclohexene-1-carboxylic acid methyl ester

(1S,5R,6S)-5-hydroxy-3-methoxy-4-methyl-7-oxabicyclo[4.1.0]hept-3-en-2-one|cyclobotryoxide

2,5-Bis(hydroxymethyl)furan monoacetate

4-Ethoxy-6-(hydroxymethyl)-2H-pyran-2-one

Foetithiphene A

Benzyl methyl sulfone

4-Chlorophenylurea

1-(4-Chlorophenyl)urea

CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3521; ORIGINAL_PRECURSOR_SCAN_NO 3517 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3539; ORIGINAL_PRECURSOR_SCAN_NO 3537 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3522; ORIGINAL_PRECURSOR_SCAN_NO 3520 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3529; ORIGINAL_PRECURSOR_SCAN_NO 3527 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3543; ORIGINAL_PRECURSOR_SCAN_NO 3541 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3540; ORIGINAL_PRECURSOR_SCAN_NO 3538 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7570; ORIGINAL_PRECURSOR_SCAN_NO 7566 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7577; ORIGINAL_PRECURSOR_SCAN_NO 7574 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 397; ORIGINAL_PRECURSOR_SCAN_NO 393 CONFIDENCE standard compound; INTERNAL_ID 1298; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 511; ORIGINAL_PRECURSOR_SCAN_NO 507

(+)-5-acetoxymethyl-5-methylfuran-2-one

Tetrahydroharnsaure

Nitrile-3-Hydroxy-2-quinolinecarboxylic acid

indole-3-carbonyl nitrile

A member of the class of indoles that is 1H-indole which is substituted by a nitriloacetyl group at the 3 position.

propylthiouracil

6-Propyl-2-thiouracil

H - Systemic hormonal preparations, excl. sex hormones and insulins > H03 - Thyroid therapy > H03B - Antithyroid preparations > H03BA - Thiouracils D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D013956 - Antithyroid Agents C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C885 - Antithyroid Agent D009676 - Noxae > D000963 - Antimetabolites CONFIDENCE standard compound; INTERNAL_ID 324; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2811; ORIGINAL_PRECURSOR_SCAN_NO 2809 CONFIDENCE standard compound; INTERNAL_ID 324; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2808; ORIGINAL_PRECURSOR_SCAN_NO 2807 CONFIDENCE standard compound; INTERNAL_ID 324; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2807; ORIGINAL_PRECURSOR_SCAN_NO 2805 CONFIDENCE standard compound; INTERNAL_ID 324; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2876; ORIGINAL_PRECURSOR_SCAN_NO 2874 INTERNAL_ID 324; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2811; ORIGINAL_PRECURSOR_SCAN_NO 2808 CONFIDENCE standard compound; INTERNAL_ID 324; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2811; ORIGINAL_PRECURSOR_SCAN_NO 2808 CONFIDENCE standard compound; INTERNAL_ID 2385 CONFIDENCE standard compound; INTERNAL_ID 1224 CONFIDENCE standard compound; INTERNAL_ID 1166 Propylthiouracil (6-n-Propylthiouracil), a thioamide antithyroid agent, is an orally active thyroperoxidase and type-1 deiodinase (DIO1) inhibitor. Propylthiouracil can be used for the Graves disease and hyperthyroidism research[1].

3,4-Dihydroxyphenylglycol

3,4-Dihydroxyphenylethyleneglycol

A tetrol composed of ethyleneglycol having a 3,4-dihydroxyphenyl group at the 1-position. 4-(1,2-Dihydroxyethyl)benzene-1,2-diol, a normal norepinephrine metabolite, is found to be associated with Menkes syndrome.

5-hydroxy-4-methoxy-5-prop-1-en-2-ylfuran-2-one

3,4-DIHYDROXYPHENYL GLYCOL

5-hydroxy-4-methoxy-5-prop-1-en-2-ylfuran-2-one_major

3,4-bis(methylene)-Hexanedioic acid

dechloro-Honaucin A

vinylic Honaucin A

2,5-Dimethyl-3-furanthiol acetate

Ethanethioic acid, S-(2,5-dimethyl-3-furanyl) ester

Furaneol acetate

3(2H)-Furanone, 4-hydroxy-2,5-dimethyl-, acetate

FEMA 3347

Propanethioic acid, S-(2-furanylmethyl) ester

Herierin III

6-Methyl-2,5-dihydroxymethyl-gamma-pyranone III

Herierin IV

5-(1-Hydroxyethyl)-2-(hydroxymethyl)-(-)-4H-pyran-4-one

WE 8:3;O2

2,4-Hexadienedioic acid 1-ethyl ester

2-ETHYLTHIO-5-METHYL-3H-PYRIMIDIN-4-ONE

Diethyl squarate

2-Amino-5-fluoro-3-pyridinecarboxylic acid methyl ester

(2-Fluorophenyl)(hydroxy)acetic acid

Bicyclo[1.1.1]pentane-1,3-dicarboxylic acid monomethyl ester

4-Pyrimidinecarboxylicacid,1,6-dihydro-5-hydroxy-6-oxo-,methylester(9CI)

2-(4-chlorophenyl)propan-1-ol

3,3,3-Trifluoro-2,2-dimethylpropionic acid methyl ester

BIS(HYDROXYMETHYL)PHENYLPHOSPHINE

5-Butyl-2-chloropyrimidine

C8H11ClN2 (170.0611)

Ethanedioic acid,1,2-di-2-propen-1-yl ester

1-Methyl-4-(methylsulfonyl)benzene

N-(5-chloropyridin-2-yl)acetamide

N-(4-Chloropyridin-2-yl)acetamide

3,5-Diethynylbenzoic acid

C11H6O2 (170.0368)

2,3-DIMETHOXYHYDROQUINONE

3-Fluoromandelic acid

4-(1,3-Oxazol-5-yl)benzonitrile

2-Phenylethanimidamide hydrochloride (1:1)

C8H11ClN2 (170.0611)

2-Chloro-N-methylisonicotinamide

4-CYANO-2-HYDROXYQUINOLINE

1-(Chloromethyl)-4-ethoxybenzene

3-hydroxyquinoline-2-carbonitrile

2-Oxo-1,2-dihydro-3-quinolinecarbonitrile

1-(2-Fluorophenyl)thiourea

C7H7FN2S (170.0314)

N-(4-CHLORO-3-PYRIDINYL)ACETAMIDE

6-Mercaptopurine monohydrate

C5H6N4OS (170.0262)

C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents C308 - Immunotherapeutic Agent > C574 - Immunosuppressant D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents 6-Mercaptopurine hydrate (Mercaptopurine hydrate; 6-MP hydrate) is a purine analogue which acts as an antagonist of the endogenous purines and has been widely used as antileukemic agent and immunosuppressive agent.

4-METHYLENE-CYCLOPENTANE-1,2-DICARBOXYLIC ACID

Ethyl 4,4,4-Trifluorobutyrate

3,5-Difluoropropiophenone

Dimethyl trans,trans-muconate

2,4-Hexadienedioicacid, 1,6-dimethyl ester, (2E,4E)-

Dimethyl 1-cyclobutene-1,2-dicarboxylate

(2-Fluoro-4-hydroxyphenyl)acetic acid

ethyl phenylphosphinate

4-Cyclohexene-1,2-dicarboxylicacid

2-methoxy-4-nitro-1-oxidopyridin-1-ium

2,3-DIHYDRO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDIN-6-YLMETHANOL

Benzeneethanol, a-(chloromethyl)-

Ethyl 2-thienylacetate

Methyl orotate

6-amino-5-nitroso-3-methyluracil

2-fluoro-4-methyl-5-nitroaniline

2-Amino-5-chlorobenzamide

Methyl 3-fluoro-4-hydroxybenzoate

diethylbut-2-indioat

1H-Imidazole-2-carboxylicacid,4,5-dihydro-4,5-dioxo-,ethylester(9CI)

4-chlorobenzhydrazide

4-fluorophenoxyacetic acid

TCMDC-123469

(2R,3S)-1-CARBOXY-2,3-DIHYDROXY-4-METHYLCYCLOHEXA-4,6-DIENE

4-methoxy-3-methylbenzyl chloride

1-(3-fluorophenyl)-2-thiourea

C7H7FN2S (170.0314)

3,4-difluoropropiophenone

4-Chloro-N-hydroxybenzenecarboximidamide

1-Phenoxy-2-chloropropane

(3-Fluorophenoxy)acetic acid

4-Fluorophenylthiourea

C7H7FN2S (170.0314)

5-Pyrimidineaceticacid, 1,2,3,4-tetrahydro-2,4-dioxo-

2,4-dimethoxybenzenethiol

1,3-(2H4)Benzenedicarboxylic acid

C8H2D4O4 (170.0517)

Methyl 3-fluoro-5-hydroxybenzoate

2,2,2-trifluoroethyl butyrate

Benzyl 2-Chloroethyl Ether

Methyl-3-(2-thienyl)=propionate

Acetic acid, [(5-methyl-3-isoxazolyl)amino]oxo- (9CI)

Acetic acid,2,2,2-trifluoro-, butyl ester

2-Fluoro-4-methoxyphenylboronic acid

TRIMETHYL-THIOPHEN-2-YLMETHYL-SILANE

C8H14SSi (170.0585)

4-Cyclohexene-1,2-dicarboxylicacid, (1R,2R)-rel-

6-Carboxymethyluracil

4-Ethyl-5-methylthiophene-3-carboxylic acid

Phthalic Acid-d4

C8H2D4O4 (170.0517)

2-CHLORO-5-ETHYLANISOLE

4-Hydroxychinolin-3-carbonitril

4-(1H-1,2,4-TRIAZOL-1-YL)BENZONITRILE

N-(2-aminoethyl)thiophene-2-carboxamide

6-(difluoromethoxy)nicotinonitrile

C7H4F2N2O (170.0292)

3-AZABICYCLO[3.1.0]HEXAN-6-AMINE

C5H12Cl2N2 (170.0377)

2-(4-nitro-1H-imidazol-5-yl)guanidine

C4H6N6O2 (170.0552)

6-methyl-5-nitro-1H-pyridine-2,4-dione

1H-Imidazo[4,5-g]phthalazine(9CI)

methyl 4,5-dimethylthiophene-2-carboxylate

2-Formyl-1H-indole-6-carbonitrile

2-Fluoro-5-hydroxy-4-methylbenzoic acid

3-Fluoro-5-(hydroxyMethyl)phenylboronic Acid

3-(Cyanoacetyl)benzonitrile

Methyl 3-fluoro-2-hydroxybenzoate

1-(2-CHLOROPHENYL)-1-PROPANOL

2,4-Difluoropropiophenone

3-Chlorobenzhydrazide

1-chloro-2-ethyl-4-methoxybenzene

3-Fluoro-4-methoxybenzoic acid

Methyl 4-fluoro-2-hydroxybenzoate

6-(1H-Imidazol-1-yl)nicotinonitrile

Propanedinitrile,2-(2-phenylhydrazinylidene)-

4-Methoxy-6-methyl-2-(methylthio)pyrimidine

2-(2,4-difluorophenyl)prop-2-en-1-ol

2-((6-OXO-1,6-DIHYDROPYRIDAZIN-3-YL)OXY)ACETIC ACID

ETHYL 4-OXO-3,4-DIHYDRO-2H-PYRAN-2-CARBOXYLATE

6-chloro-N-methylpyridine-3-carboxamide

2-CARBOXYLATE-1-METHYL-3-NITROPYRROLE

4-Methoxy-5-nitro-2-pyridinol

3-(3,4-DIFLUORO-PHENYL)-PROPIONALDEHYDE

2-Amino-[1,8]naphthyridine-3-carbonitrile

5,6-DIHYDROXY-2-METHYL-PYRIMIDINE-4-CARBOXYLIC ACID

1H-Imidazo[4,5-c][2,7]naphthyridine (9CI)

3-Formyl-1H-indole-6-carbonitrile

2,5-Dimethoxythiophenol

4-Fluoromandelic Acid

2-Fluoro-5-methoxybenzoic acid

3,4-DIMETHOXYTHIOPHENOL

3-(3-CHLORO-5-FLUOROPHENYL)-1-PROPENE

C9H8ClF (170.0299)

2-Aminoquinazoline-6-carbonitrile

(3-Chloro-4-methylphenyl)boronic acid

(2-Fluoro-3-methoxyphenyl)boronic acid

methyl 4-nitro-1H-pyrrole-2-carboxylate

4-aMino-2-chlorobenzaMide

4-methyl-2,6-dioxo-3H-pyrimidine-5-carboxylic acid

2-(3,6-dioxo-2H-pyridazin-1-yl)acetate

4-Pyrimidinecarboxylicacid, 1,2,3,6-tetrahydro-5-methyl-2,6-dioxo-

4-Nitro-1H-pyrrole-2-carbohydrazide

2-CHLOROBENZAMIDEOXIME

(1R)-3-chloro-1-phenylpropan-1-ol

(1R)-3-Chloro-1-phenyl-propan-1-ol

4-OXO-3,4-DIHYDROQUINOLINE-6-CARBONITRILE

3-(3-Chlorophenyl)-1-propanol

IMIDAZO[1,2-A]PYRIDIN-2(3H)-ONE HYDROCHLORIDE

2-Oxo-1,2-Dihydroquinoline-7-Carbonitrile

1-(4-FLUOROBENZYL)-2-CHLOROBENZIMIDAZOLE

2-ethynyl trifluorotoluene(2-(trifluoromethyl)phenylacetylene)

3-Ethynylbenzotrifluoride

6-Cyano-2-quinolone

2-Methyl-2-(2-thienyl)-1,3-dioxolane

6H-imidazo[4,5-g]cinnoline

8-hydroxyquinoline-2-carbonitrile

3-AMINO-2-QUINOXALINECARBONITRILE

3-Chlorobenzamidoxime

[3-(chloromethyl)phenyl]boronic acid

4-(2-Thienyl)butyric acid

4-(2-Thienyl)butanoic acid

phosphorodiamidic chloride, tetramethyl-

C4H12ClN2OP (170.0376)

2,5-difluoropropiophenone

4-Fluoro-2-methoxybenzoic acid

3,4-Dimethoxy thiophenol

4-Fluoro-m-anisic acid

N-(2-Chloropyridin-4-yl)acetamide

3-Fluoro-2-methyl-6-nitroaniline

1H-Imidazole-4,5-dicarboxylicacid, 2-methyl-

4-Chloro-3-ethyl-5-methyl-phenol

5-NITRO-2,4,6-TRIAMINOPYRIMIDINE

C4H6N6O2 (170.0552)

(3-chloro-2-methylphenyl)boronic acid

Olpimedone

Methyl 2-fluoro-3-hydroxybenzoate

Ethyl 3,3,3-trifluoro-2-methylpropanoate

Methyl 4,6-dihydroxypyridazine-3-carboxylate

(3-Fluoro-4-(hydroxymethyl)phenyl)boronic acid

2-(4-formyl-3-Methylthiophen-2-yl)ethyl acetate

methyl 3-amino-5-fluoropyridine-2-carboxylate

Imidazo[1,2-a]indol-9-one

5-HYDROXYMETHYL-FURAN-2-CARBOXYLIC ACID ETHYL ESTER

3-Fluoro-4-methoxybenzeneboronic acid

2-(DIMETHYLAMINO)-4-METHYLTHIAZOLE-5-CARBALDEHYDE

3-Fluoro-4-hydroxy-5-methoxybenzaldehyde

DIMETHYL PHENYLPHOSPHONITE

trans,trans-1,4-diacetoxy-1,3-butadiene

(5-Chloro-2-methylphenyl)boronic acid

2-Chloro-N-pyridin-2-ylacetamide

3-Fluoro-5-methoxybenzoic acid

1-allyl-3-chloro-4-fluorobenzene

C9H8ClF (170.0299)

1-(Chloromethyl)-2-Ethoxybenzene

N-Methyl-4-chloropyridine-2-carboxamide

2-Fluoro-6-methoxyphenylboronic acid

2-(2,4-dioxopyrimidin-1-yl)acetic acid

5-HYDROXYMETHYL-2-METHYL-FURAN-3-CARBOXYLIC ACID METHYL ESTER

(2-Fluoro-3-(hydroxymethyl)phenyl)boronic acid

5-Fluoro-2-hydroxymethylphenylboronic acid

4-(1,3-Thiazol-2-yl)morpholine

2-Chloro-N-(pyridin-4-yl)acetamide

6-AMINO-2-METHYL-5-NITROPYRIMIDIN-4(1H)-ONE

6-METHYL-5-NITROPYRIDINE-2,4-DIOL

Methyl 2-fluoro-5-hydroxybenzoate

1-Oxo-1,2-dihydroisoquinoline-4-carbonitrile

Ethyl (1R,5R,6S)-2-thiabicyclo[3.1.0]hex-3-ene-6-carboxylate

5,5,5-Trifluoropentanoic acid methyl ester

4-fluorophenylglyoxal hydrate

4-fluoro-3-(hydroxymethyl)benzeneboronic acid

1-(3-Amino-2-chloro-4-pyridinyl)ethanone

3-(2-Chlorophenyl)-1-propanol

3,4-DIHYDRO-2,2-DIMETHYL-4-OXO-2H-PYRAN-6-CARBOXYLIC ACID

4-Chloro-2-methylphenylboronic acid

4-Hydroxy-6-methyl-3-nitro-2(1H)-pyridinone

5-propyl-2-thiouracil

5-acetyl-1,3-diazinane-2,4,6-trione

Sodium phenolate hydrate (1:1:3)

C6H11NaO4 (170.0555)

(2-Chloro-3-methylphenyl)boronic acid

4-Cyanobenzoylacetonitrile

2-oxotetrahydrofuran-3-yl methacrylate

3-Methoxy-5-nitropyridin-2-ol

2-Hydroxy-6-methoxy-3-nitropyridine

2-(methylthio)pyrimidine-5-boronic acid

C5H7BN2O2S (170.0321)

3-(4-chlorophenyl)propanol

3-(4-Chlorophenyl)propan-1-ol

2-(2-Fluorophenyl)-2-hydroxyacetic acid

2-FLUORO-N,4-DIHYDROXYBENZIMIDAMIDE

2-Fluoro-4-methyl-6-nitroaniline

(2-Fluoro-5-methoxyphenyl)boronic acid

5-CHLOROSALICYLALDEHYDE

1H-Imidazo[4,5-c][1,7]naphthyridine (9CI)

1H-Imidazo[4,5-c][1,5]naphthyridine (9CI)

1H-Imidazo[4,5-g]quinoxaline(8CI,9CI)

Methyl 4-fluoro-3-hydroxybenzoate

2,6-Difluorophenylacetone

6-Isocyanatoquinoline

3-Fluoro-4-hydroxyphenylacetic acid

Methyl 2-fluoro-6-hydroxybenzoate

6-(1H-PYRAZOL-1-YL)NICOTINONITRILE

4-Fluoro-5-methyl-2-nitroaniline

(S)-3-Chloro-1-phenyl-1-propanol

Pyrimidine, 4-ethoxy-2-(methylthio)-

5-Pyrimidinecarboxylicacid, 1,2,3,6-tetrahydro-1-methyl-2,6-dioxo-

6-CHLORO-4-(METHYLAMINO)NICOTINALDEHYDE

Ethyl 2-methylthiophene-3-carboxylate

2H-Naphtho[1,8-bc]furan-2-one

C11H6O2 (170.0368)

4,6-Difluoro-1H-benzo[d]imidazol-2(3H)-one

C7H4F2N2O (170.0292)

2-chloro-5-methylphenylboronic acid

2-AMINO-5-NITRO-1,4-BENZENEDIOL

1H-Imidazo[4,5-g]quinazoline(9CI)

5-Propyl-thiophene-2-carboxylic acid

3-Thiophenecarboxylicacid,4,5-dimethyl-,hydrazide(9CI)

5-Ethylthiophene-3-carbohydrazide

Sodium (2E)-3-phenylacrylate

C9H7NaO2 (170.0344)

4-propoxy-pyrimidine-2-thiol

2-Fluoro-4-methoxybenzoic acid

2,5-dimethyl-2,4-hexadienedioic acid

3-(3,5-difluorophenyl)propenol

5-Fluoro-2-methyl-4-nitroaniline

trimethyl-(5-methylthiophen-2-yl)silane

C8H14SSi (170.0585)

(4-Fluoro-2-methoxyphenyl)boronic acid

Urea,N-(2-chlorophenyl)-

4,5-DIMETHOXYBENZENE-1,2-DIOL

2-chloro-N-pyridin-3-ylacetamide

Ethyl 3-methylthiophene-2-carboxylate

Magnesium dipropionate

C6H10MgO4 (170.043)

6-chloro-N-methylpyridine-2-carboxamide

2-(5-Oxazolyl)benzonitrile

1-(2-methylsulfanylpyrimidin-5-yl)ethanol

methyl 4-methoxy-2-oxocyclopent-3-ene-1-carboxylate

4-chloro-N-methylpyridine-3-carboxamide

5-Acetamido-1H-1,2,4-triazole-3-carboxylic acid

4-chloromethylphenylboronic acid

3-Chloro-5-methylphenylboronic acid

4-FLUORO-3-METHOXYPHENYLBORONIC ACID

5-Chloro-3,4-dihydro-2H-pyrido[4,3-b][1,4]oxazine

fosamine-ammonium

C3H11N2O4P (170.0456)

2-(3,6-DIOXO-1,2,3,6-TETRAHYDROPYRIDAZIN-4-YL)ACETIC ACID

4-fluoro-2-methyl-6-nitroaniline

(Furfurylthio)acetone

1-METHANESULFONYL-2-METHYL-BENZENE

1-(2-CHLOROETHYL)-4-METHOXYBENZENE

2-Butenethioamide, 2-cyano-3-ethoxy-

2-Fluoro-5-(hydroxymethyl)benzoic acid

3-Fluoro-2-methoxyphenylboronic acid

6,10-Dioxaspiro[4.5]decane-7,9-dione

3-Formyl-1H-indole-4-carbonitrile

1-Cyclohexene-1,3-dicarboxylic acid (6CI,9CI)

(4-Chloro-3-methylphenyl)boronic acid

6,6-Dimethyl-5,7-dioxaspiro(2.5)octane-4,8-dione

1,4-Diacetoxy-2-butyne

2-chloro-6-methylpyridine-3-carboxamide

Methyl 2-fluoro-4-hydroxybenzoate

5-phenyl-3h-[1,2,3]triazole-4-carbonitrile

4-Hydroxyquinoline-3-carbonitrile

5-ISOPROPYLTHIOPHENE-3-CARBOXYLIC ACID

Chlorodimethylphenylsilane

C8H11ClSi (170.0319)

ETHYL 3-THIOPHENEACETATE

Ethyl thiophene-3-acetate

2-Fluoro-5-(hydroxymethyl)phenylboronic acid

2,6-difluoropropiophenone

4-Azidoaniline hydrochloride

C6H7ClN4 (170.0359)

Propanedinitrile,2-benzoyl-

Urea,N-(3-chlorophenyl)-

2-Chloro-N-methylnicotinamide

methyl p-tolyl sulfone

p-Phthalic acid

C8H2D4O4 (170.0517)

3-Methoxy-4-nitropyridine 1-oxide

4,6-difluoro-2,3-dihydro-1H-inden-1-ol

2-Fluoro-6-hydroxy-3-methoxybenzaldehyde

3-Thiophenecarboxylic acid, 5-methyl-, ethyl ester

methyl 3-ethylthiophene-2-carboxylate

2-Ethynyl trifluorotoluene

5-Fluoro-2-methyl-3-nitroaniline

1-chloro-2-fluoro-4-prop-2-enylbenzene

C9H8ClF (170.0299)

4-chloro-2-methyl-5,7-dihydrofuro[3,4-d]pyrimidine

3H-imidazo[4,5-f]quinazoline

2,4-DICHLOROPHENYLHYDRAZINE HYDROCHLORIDE

2-chloro-n-hydroxy-benzamidine

METHYL 5-FLUORO-2-HYDROXYBENZOATE

3-FLUOROPHENYLGLYOXAL HYDRATE

4-fluoro-N-methyl-2-nitroaniline

Ethyl phenyl sulfone

5-Fluoro-2-methoxybenzoic acid

5-(Methoxycarbonyl)furan-2-boronic acid

C6H7BO5 (170.0387)

2-Fluoro-6-methoxybenzoic acid

bicyclo[1.1.1]pentane-1,3-diamine dihydrochloride

C5H12Cl2N2 (170.0377)

4-METHYL-2-OXOPENTANOIC ACID, SODIUM SALT, HYDRATE

C6H11NaO4 (170.0555)

[1,2,4triazolo[4,3-apyridin-7-amine

C6H7ClN4 (170.0359)

5,6-DIFLUORO-2,3-DIHYDRO-1H-INDEN-1-OL

2-(1,1-difluoroethyl)- Benzaldehyde

2-(4-nitro-1H-pyrazol-1-yl)acetamide

(2E)-3-(1-methyl-1H-pyrazol-4-yl)acryloyl chloride

METHYL 2-AMINO-6-FLUOROPYRIDINE-3-CARBOXYLATE

5-Fluoro-2-methoxybenzeneboronic acid

3-Fluoro-2-methoxybenzoic acid

2-Deoxy-2,2-difluoro-D-erythro-pentofuranose

C5H8F2O4 (170.0391)

3-THIOPHENEBUTANOIC ACID

2-Carboxy-1-cyclopentene-1-acetic acid

N-(4-Nitropyrazol-3-yl)-acetamide

4-Ethynyl-α,α,α-trifluorotoluene

Benzeneazomalononitrile

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-hydroxyethylidene)- (9CI)

3-Chloro-1-phenyl-1-propanol

2-Fluoro-3-methoxybenzoic acid

1-(4-(DIFLUOROMETHYL)PHENYL)ETHANONE

1H,2H,3H-pyrrolo[2,3-c]pyridin-2-one hydrochloride

3-Fluoro-5-hydroxy-4-methylbenzoic acid

dimethyl 2-prop-2-ynylpropanedioate

2-Thiophenecarboxylic acid, 5-Methyl-, ethyl ester

4-hydroxy-7-cyanoquinoline

2-AMINOPYRIDINE-6-CARBOXYLICACID

4-Hydroxyquinoline-6-carbonitrile

4-(methoxymethyl)benzyl chloride

1-(4-METHYL-2-(METHYLAMINO)THIAZOL-5-YL)ETHANONE

1-METHYL-4-NITRO-1H-PYRROLE-2-CARBOXYLIC ACID

1-Methylimidazole-4,5-dicarboxylic Acid

8-Hydroxyimidazo[1,2-a]pyridine, HCl

(2,6-DIMETHYLIMIDAZO[2,1-B][1,3]THIAZOL-5-YL)METHANOL

Methyl 2,4-dihydroxypyrimidine-5-carboxylate

N-(2-Chloro-3-pyridinyl)-acetamide

6-(2-FURYL)NICOTINONITRILE

3-Formyl-1H-indole-5-carbonitrile

6-Hydroxy-1-methyl-2-oxo-1,2-dihydro-4-pyrimidinecarboxylic acid

5-ethyl-4-methylthiophene-2-carboxylic acid

3-Amino-4-chlorobenzamide

2-Fluoro-3-hydroxymethyl-benzoic acid

2-(1H-Pyrazol-1-yl)nicotinonitrile

2-(1H-Imidazol-1-yl)nicotinonitrile

(4-FLUORO-2-(HYDROXYMETHYL)PHENYL)BORONIC ACID

2-Fluoro-3-Methyl-6-Nitroaniline

5-Hydroxyquinoline-8-carbonitrile

2-CYANOBENZOYLACETONITRILE

7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrochloride

C6H7ClN4 (170.0359)

1-(4-chlorophenyl)propan-1-ol

5-amino-2-chlorobenzamide(SALTDATA: FREE)

(±)-Ethyl 2,3,3-trifluorobutyrate

4-Amino-3-hydroxy-benzonitrile hydrochloride

methyl methylphenylphosphinate

(1R,2S)-rel-Cyclohex-4-ene-1,2-dicarboxylic acid

2-(chloromethyl)-1-methoxy-4-methylbenzene

1H-Imidazo[4,5-f]quinoxaline(9CI)

4-HYDROXY-5-CYANOQUINOLINE

5-Fluoroacenaphthylene

C12H7F (170.0532)

(4-ETHYL-5-OXO-TETRAHYDRO-FURAN-3-YL)-ACETALDEHYDE

5-propylthiophene-3-carboxylic acid

2-amino-4,5-dimethylthiophene-3-carboxamide

3-FLUORO-5-METHOXYPHENYLBORONIC ACID

3-(Methoxycarbonyl)furan-2-boronic acid

C6H7BO5 (170.0387)

2-Chloro-4-methylphenylboronic acid

Tyrphostin 8

4-Hydroxybenzylidenemalononitrile

D000970 - Antineoplastic Agents > D020032 - Tyrphostins Tyrphostin 8 is a tyrosine kinase, with an IC50 of 560 μM for EGFR kinase. Tyrphostin 8 is also a GTPase inhibitor. Tyrphostin 8 can inhibit the protein serine/threonine phosphatase calcineurin (IC50=21 μM)[1][2][3].

2,3-difluoropropiophenone

1-(2,3-difluoro-4-methylphenyl)ethanone

1-METHYL-1H-PYRAZOLE-3,5-DICARBOXYLIC ACID

2-mercapto-6-propylpyrimidin-4-ol

2-Chloro-4-methylnicotinamide

2-Amino-6-methyl-5-nitro-3H-pyrimidin-4-one

2-Methoxy-5-Nitro-4-Pyrimidinamine

Phosphonic acid, (3,4-dihydroxybutyl)-

C4H11O5P (170.0344)

3,4-Dihydroxyphenylglycol, (R)-

2-[(3-Pyridinylamino)methylidene]propanedinitrile

4,5-Dimethoxybenzene-1,3-diol

3,5-Dimethoxybenzene-1,2-diol

Bis(2-chloroisopropyl) ether

C6H12Cl2O (170.0265)

Benzene, 1-(1-chloroethyl)-4-methoxy-

3,1-Benzoxazepine-2-carbonitrile

2-Methyl-3-(2-Aminothiazolo)propanal

Technetium Tc 99m Pertechnetate

H8O4Tc (170.0423)

D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019275 - Radiopharmaceuticals

15233-65-5

4-06-00-07684 (Beilstein Handbook Reference)

5-Hydroxy-4-methoxy-5-(1-methylethenyl)-2-furanone

Dihydrofumigatin

3,4-Dimethoxycatechol

hexaaquairon(III)

FeH18O6+9 (170.0453)

(1S,6R)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid

Hexaoxidanium;iron(2+)

FeH18O6+8 (170.0453)

hexaaquairon(I)

FeH18O6+6 (170.0453)

(1R,6S)-1,6-dihydroxy-4-methylcyclohexa-2,4-diene-1-carboxylic acid

5-ureidoimidazole-4-carboxylic acid

1,6-dihydroxy-2-methylcyclohexa-2,4-dienecarboxylic acid

2,5-Dimethyl-4-oxo-4,5-dihydrofuran-3-yl acetate

Ethylene diacrylate

Ethylene glycol diacrylate

D013501 - Surface-Active Agents > D011092 - Polyethylene Glycols D001697 - Biomedical and Dental Materials

Furfuryl thiopropionate

S-(2-Furylmethyl) propanethioate

3,4-Methyleneadipic acid

1,6-dihydroxy-5-methylcyclohexa-2,4-dienecarboxylic acid

Dihydroxyphenylglycol

6-methoxy-3-methylbenzene-1,2,4-triol

1-(3,4-dimethoxyfuran-2-yl)ethanone

2-acetyl-3,5-dihydroxycyclohex-2-en-1-one

2-hydroxy-1-[5-(hydroxymethyl)furan-2-yl]propan-1-one

4-ethoxy-6-hydroxymethyl-α-pyrone

{"Ingredient_id": "HBIN010376","Ingredient_name": "4-ethoxy-6-hydroxymethyl-\u03b1-pyrone","Alias": "NA","Ingredient_formula": "C8H10O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7404","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

6-methyl-2,5-dihydroxymethyl-gamma-pyranone(iii)