Exact Mass: 170.0732

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.

2-Biphenylol

2-phenylphenate tetrahydrate

2-Biphenylol is found in lemon. It is an antifungal agent and preservative. 2-Biphenylol is used for post-harvest control of storage disease in apples, citrus fruit, stone fruit, tomatoes, cucumber and peppers through the use of impregnated wrapping materials or by direct application in a wax. 2-Biphenylol is used in food seasonings. Inhibitory to a wider range of moulds than Biphenyl HMJ12-A. The practical way of treatment is to immerse citrus fruit in an alkaline aqueous solution of the parent compound or its Na salt Antifungal agent, preservative. It is used for post-harvest control of storage disease in apples, citrus fruit, stone fruit, tomatoes, cucumber and peppers through the use of impregnated wrapping materials or by direct application in a wax. It is used in food seasonings. Inhibitory to a wider range of moulds than Biphenyl HMJ12-A. The practical way of treatment is to immerse citrus fruit in an alkaline aq. soln. of the parent compound or its Na salt. 2-Biphenylol is found in lemon. CONFIDENCE standard compound; INTERNAL_ID 1392; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9460; ORIGINAL_PRECURSOR_SCAN_NO 9456 CONFIDENCE standard compound; INTERNAL_ID 1392; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9365; ORIGINAL_PRECURSOR_SCAN_NO 9363 CONFIDENCE standard compound; INTERNAL_ID 1392; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9398; ORIGINAL_PRECURSOR_SCAN_NO 9393 CONFIDENCE standard compound; INTERNAL_ID 1392; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9460; ORIGINAL_PRECURSOR_SCAN_NO 9457 CONFIDENCE standard compound; INTERNAL_ID 1392; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9464; ORIGINAL_PRECURSOR_SCAN_NO 9459 CONFIDENCE standard compound; INTERNAL_ID 1392; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9412; ORIGINAL_PRECURSOR_SCAN_NO 9407 CONFIDENCE standard compound; INTERNAL_ID 970; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4368; ORIGINAL_PRECURSOR_SCAN_NO 4365 CONFIDENCE standard compound; INTERNAL_ID 970; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4893; ORIGINAL_PRECURSOR_SCAN_NO 4890 CONFIDENCE standard compound; INTERNAL_ID 970; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4862; ORIGINAL_PRECURSOR_SCAN_NO 4859 CONFIDENCE standard compound; INTERNAL_ID 970; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4365; ORIGINAL_PRECURSOR_SCAN_NO 4361 CONFIDENCE standard compound; INTERNAL_ID 970; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4839; ORIGINAL_PRECURSOR_SCAN_NO 4835 CONFIDENCE standard compound; INTERNAL_ID 970; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4882; ORIGINAL_PRECURSOR_SCAN_NO 4877 D - Dermatologicals > D08 - Antiseptics and disinfectants > D08A - Antiseptics and disinfectants > D08AE - Phenol and derivatives D009676 - Noxae > D002273 - Carcinogens D000890 - Anti-Infective Agents D016573 - Agrochemicals D004202 - Disinfectants D010575 - Pesticides

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

N-Isopropylammelide

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

4-Biphenylol

4-Hydroxybiphenyl

CONFIDENCE standard compound; INTERNAL_ID 1154; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4839; ORIGINAL_PRECURSOR_SCAN_NO 4835 CONFIDENCE standard compound; INTERNAL_ID 1154; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4862; ORIGINAL_PRECURSOR_SCAN_NO 4859 CONFIDENCE standard compound; INTERNAL_ID 1154; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4882; ORIGINAL_PRECURSOR_SCAN_NO 4877 CONFIDENCE standard compound; INTERNAL_ID 1154; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4893; ORIGINAL_PRECURSOR_SCAN_NO 4890 CONFIDENCE standard compound; INTERNAL_ID 1154; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4872; ORIGINAL_PRECURSOR_SCAN_NO 4871 CONFIDENCE standard compound; INTERNAL_ID 1154; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4890; ORIGINAL_PRECURSOR_SCAN_NO 4887

3-Biphenylol

3-Hydroxybiphenyl

Imetit

{[2-(1H-imidazol-5-yl)ethyl]sulfanyl}methanimidamide

D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D017442 - Histamine Agonists

N-NITROSOGUVACOLINE

Methyl beta-naphthyl ketone

1-(naphthalen-2-yl)ethan-1-one

Methyl beta-naphthyl ketone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") 2-Acetonaphthone is an endogenous metabolite.

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.

Diphenyl ether

2,2,3-Trihydroxydiphenylether

Diphenyl ether is found in alcoholic beverages. Diphenyl ether is present in muscat grapes, green tea, vanilla, lemon balm, buckwheat, potato chips and grilled beef. Diphenyl ether is a flavouring ingredient Diphenyl ether is a starting material in the production of phenoxathiin via the Ferrario reaction. Phenoxathiin is used in polyamide and polyimide production. Involving similar reactions, diphenyl ether is a significant side product in the high-pressure hydrolysis of chlorobenzene in the production of phenol. Several polybrominated diphenyl ethers (PBDEs) are useful flame retardants. Of penta-, octa-, and decaBDE, the three most common PBDEs, only deca-BDE is still in widespread use since its ban in the European Union in 2003. Deca-BDE, also known as decabromodiphenyl oxide, is a high-volume industrial chemical with over 450,000 kilograms produced annually in the United States. Decabromodiphenyl oxide is sold under the trade name Saytex 102 as a flame retardant in the manufacture of paints and reinforced plastics Present in muscat grapes, green tea, vanilla, lemon balm, buckwheat, potato chips and grilled beef. Flavouring ingredient

2-Amino-5-phenylpyridine

5-Phenyl-2-pyridinamine, 9ci

2-Amino-5-phenylpyridine is a mutagen found in cooked foo 2-Amino-5-phenylpyridine is a mutagenic heterocyclic aromatic amine that is formed by pyrolysis of phenylalanine in proteins. 2-Amino-5-phenylpyridine is in broiled sardines and is considered as potentially carcinogenic[1][2].

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.

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.

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

Linsidomine

5-azanidyl-3-(morpholin-4-yl)-1,2,3lambda5-oxadiazol-3-ylium

C - Cardiovascular system > C01 - Cardiac therapy > C01D - Vasodilators used in cardiac diseases C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D020030 - Nitric Oxide Donors D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D004791 - Enzyme Inhibitors

Penicillic acid

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

Methylglyoxal-bis-guanylhydrazone

{N-[(1-oxopropan-2-ylidene)amino]carbamimidamido}methanimidamide

C5H10N6O (170.0916)

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.

1-(4-methoxyphenyl)-2,4-pentadiyne|1-(p-Methoxyphenyl)-pentadiin-(2,4)|1-<4-Methoxy-phenyl>-pentadiin-(2,4)

5-Methoxy-2-(methoxymethyl)-4-pyranone

5-(hydroxymethyl)-2-methoxybenzene-1,3-diol

3,3a,7,7a-tetrahydro-6,7-dihydroxy-2(6H)-1-benzofuran-2-one

(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

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

2,5-dimethoxybenzene-1,3-diol

coriloxin

3-Hexa-2,4-diinyl-phenol

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

Nitrile-1H-Indole-3-propanoic acid

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

5-Methyl-2,3-bipyridine

4-METHYL-3,3-BIPYRIDINE

1-(2-Hydroxyphenyl)-2,4-hexadiyne|2-(Hexadiin-(2,4)-yl)-phenol|2--phenol

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

2,4,6-Triazabicyclo[3.2.1]oct-2-ene-7-carboxylicacid,3-amino-,(1R,5S,7S)-(9CI)

(Z)-2-(3-Indolyl)vinyl Isocyanide|Indolacrylisonitril

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

2-Acetonaphthone

2-Acetylnaphthalene

CONFIDENCE standard compound; INTERNAL_ID 1243; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4862; ORIGINAL_PRECURSOR_SCAN_NO 4859 CONFIDENCE standard compound; INTERNAL_ID 1243; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4890; ORIGINAL_PRECURSOR_SCAN_NO 4887 CONFIDENCE standard compound; INTERNAL_ID 1243; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4839; ORIGINAL_PRECURSOR_SCAN_NO 4835 CONFIDENCE standard compound; INTERNAL_ID 1243; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4872; ORIGINAL_PRECURSOR_SCAN_NO 4871 CONFIDENCE standard compound; INTERNAL_ID 1243; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4893; ORIGINAL_PRECURSOR_SCAN_NO 4890 CONFIDENCE standard compound; INTERNAL_ID 1243; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4882; ORIGINAL_PRECURSOR_SCAN_NO 4877 CONFIDENCE standard compound; INTERNAL_ID 2446 2-Acetonaphthone is an endogenous metabolite.

3,4-DIHYDROXYPHENYL GLYCOL

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

2,3,4-Trihydroxybenzylhydrazide

SIN-1 Chloride

5-amino-3-(4-morpholinyl)-1,2,3-oxadiazolium chloride

N-Nitroso-N-morpholinoaminoacetonitrile

3,4-bis(methylene)-Hexanedioic acid

dechloro-Honaucin A

vinylic Honaucin A

Phe-p-1

5-Phenyl-2-pyridinamine, 9ci

2-Amino-5-phenylpyridine is a mutagenic heterocyclic aromatic amine that is formed by pyrolysis of phenylalanine in proteins. 2-Amino-5-phenylpyridine is in broiled sardines and is considered as potentially carcinogenic[1][2].

&beta

1-(naphthalen-2-yl)ethan-1-one

2-Acetonaphthone is an endogenous metabolite.

Furaneol acetate

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

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

Diethyl squarate

1,3-DIACETYL-2-IMIDAZOLIDINONE

5,7-Dimethyl-1H-indole-4-carbonitrile

5-isopropylbarbituric acid

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

Carbamic acid, (5-methyl-3-isoxazolyl)-, ethyl ester

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

5-Butyl-2-chloropyrimidine

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

2-Thiazolemethanamine,N-methyl-4-(1-methylethyl)-(9CI)

1H-1,2,4-Triazole-3-carboxylicacid,5-amino-,propylester(9CI)

1H-Pyrrolo[1,2-a]benzimidazole,1-methyl-(9CI)

4-Isoxazolepropanoicacid,5-amino-3-methyl-(9CI)

2,3-DIMETHOXYHYDROQUINONE

3-(2-HYDROXY-ETHYL)-6-METHYL-1H-PYRIMIDINE-2,4-DIONE

2-Phenylethanimidamide hydrochloride (1:1)

4-Methyl-1-naphthaldehyde

Methyl 5-methoxy-1(2H)-pyrazinecarboxylate

(4,6-DIMETHOXY-PYRIMIDIN-2-YL)-HYDRAZINE

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

4-Cyclohexene-1,2-dicarboxylicacid

6-(Chloromethyl)-N,N-dimethylpyridin-2-amine

ETHYL 2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE

2-(6-chloropyridin-3-yl)propan-2-amine

isoindolin-2-amine hydrochloride

Pyrimidine, 5-methyl-4-phenyl- (6CI,9CI)

Pyrimidine, 4-(phenylmethyl)- (9CI)

5-AMINO-2,6-DIMETHOXY-3-HYDROXYPYRIDINE

1H-Imidazole-4-carboxylicacid,2-methoxy-5-methyl-,methylester(9CI)

3-FLUORO-4-METHOXYPHENETHYL ALCOHOL

1,2-dihydroacenaphthylen-5-ol

3-CHLORO-6-METHYL-5-PROPYLPYRIDAZINE

2-(2,4-difluoro-phenyl)-acetamidine

C8H8F2N2 (170.0656)

diethylbut-2-indioat

5-BROMO-3-METHOXYPYRIDIN-2-AMINE

1-Acetonaphthone

2-Isopropyl-4-(methylaminomethyl)thiazole

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

(7-methyl-1H-indol-3-yl)acetonitrile

3,4-difluoropropiophenone

2,4,6-Trimethoxypyrimidine

2-METHYL-5-NITROANILINE HYDRATE

Ethyl 5-(hydroxymethyl)-1H-pyrazole-3-carboxylate

4-Chloro-5-ethyl-2,6-dimethylpyrimidine

1H-Cyclopenta[b]quinoxaline,2,3-dihydro-

5-Isoxazolealanine,3-methyl-(6CI)

2,2,2-trifluoroethyl butyrate

2-PIPERIDINOETHYL ISOTHIOCYANATE

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-

DIPYRIDIN-2-YLMETHANE

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

4-CHLORO-5-ISOPROPYL-6-METHYLPYRIMIDINE

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

C4H6N6O2 (170.0552)

1-(4-chloro-2-methylphenyl)-1-methylhydrazine

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

3-Fluoro-5-(hydroxyMethyl)phenylboronic Acid

1H-Pyrazole-3-acetic acid, 4,5-dihydro-5-oxo-, ethyl ester

4-Methylbenzene-1-carboximidamide hydrochloride

1-(4-FLUORO-3-METHOXYPHENYL)ETHAN-1-OL

1-(5-Fluoro-2-methoxyphenyl)ethanol

(R)-(+)-1 1 1-TRIFLUOROHEPTAN-2-OL

C7H13F3O (170.0918)

2,4-Difluoropropiophenone

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

ethyl 5-methyl-2-oxo-1,3-dihydroimidazole-4-carboxylate

Propanedinitrile,2-(2-phenylhydrazinylidene)-

ETHYL 5-AMINO-2-METHYLOXAZOLE-4-CARBOXYLATE

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

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

3-(2-isocyanoethyl)-1H-indole

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

Urea,N-hydroxy-N-[2-(1H-imidazol-4-yl)ethyl]- (9CI)

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

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

(R)-(-)-1-(4-FLUOROPHENOXY)-2-PROPANOL

N-phenylpyridin-4-amine

2-Aminoquinazoline-6-carbonitrile

(2-Fluoro-3-methoxyphenyl)boronic acid

2-methylnaphthalene-1-carbaldehyde

5-[ethoxy(hydroxy)methylidene]-2-methyl-1H-imidazol-4-one

2-(2,5-difluoro-phenyl)-acetamidine

C8H8F2N2 (170.0656)

2-(NAPHTHALEN-1-YL)OXIRANE

Ethyl 5-hydroxy-1-methyl-1H-pyrazole-4-carboxylate

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

2-CHLORO-6-TERT-BUTYL PYRAZINE

1-allyl-3-vinylimidazolium chloride

3-AMINO-2-QUINOXALINECARBONITRILE

5,6-Diamino-1,3-Dimethyluracil

2,5-difluoropropiophenone

5-NITRO-2,4,6-TRIAMINOPYRIMIDINE

C4H6N6O2 (170.0552)

6-amino-1-methyl-5-(methylamino)pyrimidine-2,4-dione

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

N-(6-METHYL-3-OXO-2,3-DIHYDRO-1,2,4-TRIAZIN-4(5H)-YL)ACETAMIDE

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

ETHYL 2-METHYL-5-OXO-2,5-DIHYDRO-1H-PYRAZOLE-3-CARBOXYLATE

N-[(6-Chloro-3-pyridinyl)methyl]ethanamine

2-(pyridin-3-ylmethyl)pyridine

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

4-(chloromethyl)-N,N-dimethylpyridin-2-amine

2-METHYL-1-(PROP-2-YN-1-YL)-1H-BENZO[D]IMIDAZOLE

4-chlorophenelzine

3-Fluoro-4-methoxybenzeneboronic acid

2-Methylbenzamidine hydrochloride

2-Anilinopyridine

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

2-(4-Aminophenyl)pyridine

naphthalene-1-carboximidamide

2-(2,6-difluoro-phenyl)-acetamidine

C8H8F2N2 (170.0656)

4-Phenylpyridin-2-amine

2-Amino-3-phenylpyridine

1,3-dimethyl-6-hydrazinouracil

2-Fluoro-6-methoxyphenylboronic acid

1-ethyl-5-methyl-4-nitro-1H-pyrazol-3-amine(SALTDATA: FREE)

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

5-Amino-3-methyl-isoxazole-4-carboxylic acid ethyl ester

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

5-Fluoro-2-hydroxymethylphenylboronic acid

(S)-1,2-DIHYDROACENAPHTHYLEN-1-OL

Ethyl acetamido(cyano)acetate

5,5,5-Trifluoropentanoic acid methyl ester

6-Methoxy-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione

5-METHYL-[2,3]-BIPYRIDINE

4-fluoro-3-(hydroxymethyl)benzeneboronic acid

2-(3-Aminophenyl)pyridine

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

1-Methylimidazolium tetrafluoroborate

C4H7BF4N2 (170.0638)

Sodium phenolate hydrate (1:1:3)

C6H11NaO4 (170.0555)

2-oxotetrahydrofuran-3-yl methacrylate

4-Thiazoleethanamine,2-(1-methylethyl)-(9CI)

2-(4-ETHOXY-PHENYL)-1-METHYL-ETHYLAMINE HYDROCHLORIDE

2-(5-methyl-1H-indol-3-yl)acetonitrile

2-Benzylpyrazine

2-pyrimidinemethanol,4,6-dimethoxy-

1-butylimidazolidine-2,4,5-trione

4-Chloro-2-methyl-5-propylpyrimidine

2-[(4-ethynylphenyl)Methylamino]-acetonitrile

3-PYRIDIN-4-YLANILINE

2-(naphthalen-2-yl)acetaldehyde

1H-Imidazole-4-carboxylicacid,2-(methoxymethyl)-,methylester(9CI)

(2-Fluoro-5-methoxyphenyl)boronic acid

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)

3,4-BIS(1-METHYLHYDRAZINO)CYCLOBUT-3-ENE-1,2-DIONE

5-chloro-2-(ethylamino)aniline

Isoindolin-5-amine hydrochloride

2-Aminohistidine

5-(TERT-BUTYL)-4-METHYLTHIAZOL-2-AMINE

2,6-Difluorophenylacetone

INDOLIN-1-AMINEHYDROCHLORIDE

3-METHYL-5-PHENYLPYRIDAZINE

Ethanethioic acid,S-bicyclo[2.2.1]hept-2-yl ester

C9H14OS (170.0765)

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

1-ethyl-1H-indole-5-carbonitrile

5,6,7,8-Tetrahydro-1,6-naphthyridine hydrochloride

1,2,3,4-Tetrahydro-2,7-naphthyridine hydrochloride

1-Butyl-3,5-difluorobenzene

6-Vinyl-2-Naphthol

methyl 2,2-dimethyl-1-oxidoimidazol-1-ium-4-carboxylate

3-FLUORO-4-METHOXY-BENZYL-HYDRAZINE

C8H11FN2O (170.0855)

2-PYRIDIN-4-YL-PHENYLAMINE

2,5-Dimethoxy-4-hydrazinopyrimidine

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

4-Pyridin-3-ylaniline

3-Methylbenzenecarboximidamide hydrochloride

4-Oxazolecarboxylicacid,2-(aminomethyl)-5-methyl-,methylester(9CI)

Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate

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

3-(3,5-difluorophenyl)propenol

(R)-2-AMINO-5,5,5-TRIFLUOROPENTANAMIDE

C5H9F3N2O (170.0667)

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

C8H14SSi (170.0585)

(4-Fluoro-2-methoxyphenyl)boronic acid

4,5-DIMETHOXYBENZENE-1,2-DIOL

Ethyl 2-amino-4-methyloxazole-5-carboxylate

2-propan-2-ylsulfonylethanol,hydrate

C5H14O4S (170.0613)

4-Methyl-2,2-bipyridin

(S)-1,1,1-TRIFLUOROHEPTAN-2-OL

C7H13F3O (170.0918)

5-FLUORO-2-ISOPROPOXYPHENOL

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

Ethyl 5-hydroxy-1-methyl-1H-pyrazole-3-carboxylate

4-FLUORO-3-METHOXYPHENYLBORONIC ACID

4-(2-METHYLTHIAZOL-4-YL)BUTAN-1-AMINE

3-ETHOXY-4-(1-METHYLHYDRAZINO)CYCLOBUT-3-ENE-1,2-DIONE

2-Chloro-N,N-dimethyl-1,4-benzenediamine

1-(2-Methoxyethyl)-1H-pyrazole-4-carboxylic acid

5-Pyrrolidin-1-yl-1,3,4-thiadiazol-2-amine

3-Fluoro-2-methoxyphenylboronic acid

2-(1-Cyanoethyl)indole

(2-Chloro-4,6-dimethylphenyl)hydrazine

5-morpholin-4-yl-1,3,4-oxadiazol-2-amine

5-METHYL-2,2-BIPYRIDYL

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

1-(pyridin-3-yl)cyclopropanamine (Hydrochloride)

2-(4-methyl-1H-indol-3-yl)acetonitrile

N-Methoxy-N,2-dimethyl-oxazole-4-carboxamide

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

4-chloro-2-methyl-6-propylpyrimidine

1H-Imidazole-4-carboxylicacid,1-(2-hydroxyethyl)-,methylester(9CI)

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

Ethyl 3-(trimethylsilyl)-2-propynoate

C8H14O2Si (170.0763)

2-(2-Aminophenyl)pyridine

1,4-Diacetoxy-2-butyne

Pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-2-hydroxy-, (S)-(9CI)

NAPHTHALENE-2-CARBOXAMIDINE

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

2-Phenyl-3-pyridinamine

2-(PYRIDIN-3-YL)ANILINE

4-(Pyridin-4-yl)aniline

2-Fluoro-5-(hydroxymethyl)phenylboronic acid

2,6-difluoropropiophenone

2-Phenylpyridin-4-amine

6-Phenylpyridin-3-amine

5-PHENYL-PYRIDIN-3-YLAMINE

4-phenylpyridin-3-amine

7-Methylnaphthalene-2-carboxaldehyde

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

ETHYL (1-METHYL-1H-1,2,3-TRIAZOL-4-YL)CARBAMATE

4-Ethyl-5-fluoro-2-methoxyphenol

Phenyl-pyridin-3-yl-amine

Thiourea,N-cyclopropyl-N-(cyclopropylmethyl)-

1H-Imidazole-4-carboxylicacid,5-hydrazino-,ethylester(9CI)

Thiourea,(2,5-dimethyl-1H-imidazol-4-yl)- (9CI)

5-Methyl-1,3-benzenediacetonitrile

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

3-(3-Pyridinyl)aniline

Acenaphthenol

1-(1,1-Difluoropropyl)-4-methylbenzene

1-(1,1-difluoropropyl)-3-methylbenzene

6,7-Dihydro-5H-cyclopenta[b]pyridin-7-aMine hydrochloride

4-(2H-tetrazol-5-yl)tetraaz-3-ene-2-carboximidamide

C2H6N10 (170.0777)

4-CHLORO-2-ISOPROPYL-6-METHYLPYRIMIDINE

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

C6H11NaO4 (170.0555)

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

2-(1,1-difluoroethyl)- Benzaldehyde

Disperse Orange 62

5-Fluoro-2-methoxybenzeneboronic acid

(E)-3-(dimethylamino)-N,2-bis(formyl)acrylamide

1-(4-Chloro-pyridin-2-yl)-1-methyl-ethylamine

N-Nitrosodiethylamine boron fluoride (1:1)

C4H10N2O.BF3 (170.0838)

1-(1,1-difluoropropyl)-2-methyl-Benzene

4-Hexenoic acid, 4-methyl-3-oxo-, ethyl ester

1,2-dimethyl-1H-indole-3-carbonitrile

(1-phenylethyl)malononitrile

3H-PYRIDO(3,4-B)INDOLE, 4,9-DIHYDRO-

2-Amino-6-phenylpyridine

3-propan-2-ylsulfanyl-1,2,4-triazin-5-amine

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

Benzeneazomalononitrile

1-(4-(DIFLUOROMETHYL)PHENYL)ETHANONE

dimethyl 2-prop-2-ynylpropanedioate

[5-(1-Aminoethyl)-4H-[1,2,4]triazol-3-yl]acetic acid hydrochloride

4-Isobutyldihydro-2H-pyran-2,6(3H)-dione

2-chloroadamantane

1H-Imidazole,2-(2-phenylethenyl)-

2,2-Dimethyl-4-oxocyclohexanecarboxylic acid

4-chloro-2-methyl-5-(1-methylethyl)pyrimidine

3-Chloro-2,5-diethyl pyrazine

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

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

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

2-(TERT-BUTYL)-4-CHLOROPYRIMIDINE

Dipyridin-3-ylmethane

3-(6-Fluoro-pyridin-2-ylamino)-propan-1-ol

C8H11FN2O (170.0855)

(±)-Ethyl 2,3,3-trifluorobutyrate

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

1-Methylindole-3-acetonitrile

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

1-Chloroadamantane

ethyl 3-ethyl-1,2,4-oxadiazole-5-carboxylate

5-Fluoroacenaphthylene

C12H7F (170.0532)

Naphthalen-1-yl-acetaldehyde

3-FLUORO-5-METHOXYPHENYLBORONIC ACID

(2-acetyl-3-oxo-but-1-enyl)urea

1-Oxaspiro[2.4]heptane-2-carboxylicacid, ethyl ester

2,3-difluoropropiophenone

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

Methyl (4-oxocyclohexyl)acetate

6-methyl-2,2-bipyridine

Ethyl 1-methyl-3-oxo-2,3-dihydro-1H-pyrazole-4-carboxylate

Ethyl 5-ethyl-1,2,4-oxadiazole-3-carboxylate

3,4-Dihydroxyphenylglycol, (R)-

2-[(3-Pyridinylamino)methylidene]propanedinitrile

2-(2-Ethoxy-1-methoxyethyl)furan

A member of the class of furans that is furan substituted by a 2-ethoxy-1-methoxyethyl group at position 2.

7-Methyl-3-oxooct-6-enoic acid

A monounsaturated oxo fatty acid comprising 3-oxooct-6-enoic acid having a methyl substituent at the 7-position.

4,5-Dimethoxybenzene-1,3-diol

3,5-Dimethoxybenzene-1,2-diol

4-Methyl-2-phenylpyrimidine

4-Methyl-6-phenylpyrimidine

(2-Furylmethoxy)(trimethyl)silane

C8H14O2Si (170.0763)

5,6,7,8-Tetrahydro-imidazo[1,2-A]pyridine-6,7,8-triol

Linsidomine

3-MORPHOLINOSYDNONIMINE

15233-65-5

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

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

Dihydrofumigatin

(E)-4-Oxonon-2-enoic acid

(2R)-2-(3,4-dihydroxyphenyl)-2-hydroxyethanaminium

C8H12NO3+ (170.0817)

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

2-(2,4,5-Trihydroxyphenyl)ethylazanium

C8H12NO3+ (170.0817)

2-butyl-4-hydroxy-5-methyl-3(2H)-furanone

(2S)-2-amino-N-hydroxy-3-(2H-imidazol-4-yl)propanamide

1-carbamimidoyl-1-[(E)-1-oxopropan-2-ylideneamino]guanidine

C5H10N6O (170.0916)

Noradrenaline(1+)

C8H12NO3+ (170.0817)

3,4-Dimethoxycatechol

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

(2,5-dihydroxy-N-methylanilino)-oxidoammonium

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

4-Cyano-2-phenyl-1-pyrroline

3-Chloro-2,6-dimethyl-1,5,7-octatriene

Exo-6-chlorocamphene

(2E)-6Acetoxy-2-methylhexenal

3-Hydroxy-4-methylenecyclohexanecarboxylic acid methyl ester

2-Phenylphenol

D - Dermatologicals > D08 - Antiseptics and disinfectants > D08A - Antiseptics and disinfectants > D08AE - Phenol and derivatives D009676 - Noxae > D002273 - Carcinogens D000890 - Anti-Infective Agents D016573 - Agrochemicals D004202 - Disinfectants D010575 - Pesticides

imetit

D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D017442 - Histamine Agonists

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

Diphenyl oxide

DIPHENYL ETHER

An aromatic ether in which the oxygen is attached to two phenyl substituents. It has been found in muscat grapes and vanilla.

(R)-noradrenaline(1+)

C8H12NO3 (170.0817)

An organic cation that is the conjugate acid of (R)-noradrenaline, obtained by protonation of the priamry amino group; major species at pH 7.3.

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

cis-3-Hexenyl pyruvate

(Z)-3-hexen-1-yl pyruvate

2-Amino-5-phenylpyridine

3,4-Methyleneadipic acid

1-(furan-3-yl)pentane-1,4-diol

Dendryphiellic acid B

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

Dihydroxyphenylglycol

Ipomeadiol

(1z)-1-phenylhex-1-en-4-yn-3-one

3-ethylidene-4-(2-hydroxyethyl)oxan-2-one

(3e,5z,7s)-7-hydroxy-5-(hydroxymethyl)octa-3,5-dien-2-one

(4ar,6s,7r,7ar)-6-hydroxy-7-methyl-hexahydro-1h-cyclopenta[c]pyran-3-one

2-(hexa-2,4-diyn-1-yl)phenol

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

(4ar,6s,7r,7as)-6-hydroxy-7-methyl-hexahydro-1h-cyclopenta[c]pyran-3-one

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

1-(3-hydroxyphenyl)-2,4-hexadiyne

{"Ingredient_id": "HBIN001251","Ingredient_name": "1-(3-hydroxyphenyl)-2,4-hexadiyne","Alias": "NA","Ingredient_formula": "C12H10O","Ingredient_Smile": "CC#CC#CCC1=CC(=CC=C1)O","Ingredient_weight": "170.21","OB_score": "NA","CAS_id": "75911-07-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9684","PubChem_id": "101410744","DrugBank_id": "NA"}

1-phenyl-2,4-hexadiyne-1-ol

{"Ingredient_id": "HBIN002978","Ingredient_name": "1-phenyl-2,4-hexadiyne-1-ol","Alias": "NA","Ingredient_formula": "C12H10O","Ingredient_Smile": "CC#CC#CC(C1=CC=CC=C1)O","Ingredient_weight": "170.21 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT17184","TCMID_id": "17109","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5320528","DrugBank_id": "NA"}

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)

{"Ingredient_id": "HBIN012543","Ingredient_name": "6-methyl-2,5-dihydroxymethyl-gamma-pyranone(iii)","Alias": "NA","Ingredient_formula": "C8H10O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31594","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

7-hydroxy-9-hydroxymethy-3-oxo-bicyclo[4.3.0]-8-nonene