Exact Mass: 145.0197482

Indole-3-carboxaldehyde (IAld or I3A), also known as 3-formylindole or 3-indolealdehyde, belongs to the class of organic compounds known as indoles. Indoles are compounds containing an indole moiety, which consists of a pyrrole ring fused to benzene to form 2,3-benzopyrrole. In humans, I3A is a biologically active metabolite which acts as a receptor agonist at the aryl hydrocarbon receptor in intestinal immune cells. It stimulates the production of interleukin-22 which facilitates mucosal reactivity (PMID:27102537). I3A is a microbially derived tryptophan metabolite produced by Clostridium and Lactobacillus (PMID:30120222, 27102537). I3A has also been found in the urine of patients with untreated phenylketonuria (PMID:5073866). I3A has been detected, but not quantified, in several different foods, such as beans, Brussels sprouts, cucumbers, cereals and cereal products, and white cabbages. This could make I3A a potential biomarker for the consumption of these foods. Indole-3-carbaldehyde is a heteroarenecarbaldehyde that is indole in which the hydrogen at position 3 has been replaced by a formyl group. It has a role as a plant metabolite, a human xenobiotic metabolite, a bacterial metabolite and a marine metabolite. It is a heteroarenecarbaldehyde, an indole alkaloid and a member of indoles. Indole-3-carboxaldehyde is a natural product found in Euphorbia hirsuta, Derris ovalifolia, and other organisms with data available. A heteroarenecarbaldehyde that is indole in which the hydrogen at position 3 has been replaced by a formyl group. Found in barley and tomato seedlings and cotton Indole-3-carboxaldehyde. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=487-89-8 (retrieved 2024-07-02) (CAS RN: 487-89-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Indole-3-carboxaldehyde (3-Formylindole), a banlangen extract, is the product of the oxidative degradation of indole-3-acetic acid (IAA) by crude enzyme preparations from etiolated pea seedlings. Indole-3-carboxaldehyde (3-Formylindole) is a biochemical used to prepare analogs of the indole phytoalexin cyclobrassinin[1]. Indole-3-carboxaldehyde (3-Formylindole), a banlangen extract, is the product of the oxidative degradation of indole-3-acetic acid (IAA) by crude enzyme preparations from etiolated pea seedlings. Indole-3-carboxaldehyde (3-Formylindole) is a biochemical used to prepare analogs of the indole phytoalexin cyclobrassinin[1].

Oxyquinoline

8-HYDROXYQUINOLINE

G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AC - Quinoline derivatives A - Alimentary tract and metabolism > A01 - Stomatological preparations > A01A - Stomatological preparations > A01AB - Antiinfectives and antiseptics for local oral treatment D - Dermatologicals > D08 - Antiseptics and disinfectants > D08A - Antiseptics and disinfectants > D08AH - Quinoline derivatives R - Respiratory system > R02 - Throat preparations > R02A - Throat preparations > R02AA - Antiseptics C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent CONFIDENCE standard compound; ML_ID 55

quinolone

2-Hydroxyquinoline

KEIO_ID Q001 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 52 CONFIDENCE standard compound; INTERNAL_ID 2491

4-Hydroxyquinoline

1,4-dihydroquinolin-4-one

CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 53 CONFIDENCE standard compound; INTERNAL_ID 2492 KEIO_ID H139

6-Chloro-1,3,5-triazine-2,4-diamine

6-chloro-1,2,3,4-tetrahydro-1,3,5-triazine-2,4-diimine

CONFIDENCE standard compound; INTERNAL_ID 2022

1-Hydroxyisoquinoline

1,2-dihydroisoquinolin-1-one

CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 70 COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

2-Keto-glutaramic acid

5-Amino-2,5-dioxopentanoic acid

deaminated metabolite of glutamine in csf of patients with hepatic coma; intermediate in the detoxification of ammonia in brain; structure [HMDB] deaminated metabolite of glutamine in csf of patients with hepatic coma; intermediate in the detoxification of ammonia in brain; structure.

3-Methyleneoxindole

Thialysine ketimine

3,4-Dehydrothiomorpholine-3-carboxylic acid

4-Oxoglutaramate

4-oxoglutaramic acid

Aminonitrothiazole

2-AMINO-5-NITROTHIAZOLE

C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent

4-[(E)-2-isocyanoethenyl]phenol

Diatretin 2

7-cyano-trans-2-Heptene-4,6-diynoic acid

Diatretin 2 is found in mushrooms. Diatretin 2 is produced by Camarophyllus virgineus (snowy wax cap Production by Camarophyllus virgineus (snowy wax cap). Diatretin 2 is found in mushrooms.

1-Thiocarbamoyl-2-imidazolidinone

2-oxoimidazolidine-1-carbothioamide

4,1-Benzoxazepine

5-Chloro-2,3-pyridinediol

5-chloro-3-hydroxy-1,2-dihydropyridin-2-one

C4H4FN3O2 (145.02875360000002)

6-Hydroxy-5-fluorocytosine

6-amino-5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione

1H-Pyrido[3,2-c][1,2]diazepine

Diaminochlorotriazine

Gimeracil

5-chloro-4-hydroxy-1,2-dihydropyridin-2-one

C471 - Enzyme Inhibitor > C2019 - Dihydropyrimidine Dehydrogenase Inhibitor

quinazolin-4-ylamine

3,4-dihydroquinazolin-4-imine

2-aceto-2-hydroxy-butanoate

2-Ethyl-2-hydroxy-3-oxobutanoic acid

2-aceto-2-hydroxy-butanoate is soluble (in water) and a weakly acidic compound (based on its pKa). 2-aceto-2-hydroxy-butanoate can be found in a number of food items such as white cabbage, pistachio, pepper (c. frutescens), and yautia, which makes 2-aceto-2-hydroxy-butanoate a potential biomarker for the consumption of these food products.

5-Methylsufinylpentyl nitrile

3-Quinolol

3-Hydroxyquinoline

1,3-Diiminoisoindoline

4-Amino-5-Chloropyridazin-6-One

5-Amino-4-chloropyridazin-3(2H)-one

Chloridazon-desphenyl

5-Amino-4-chloropyridazin-3(2H)-one

CONFIDENCE standard compound; INTERNAL_ID 2036

Chloridazone-desphenyl

5-Amino-4-chloropyridazin-3(2H)-one

A heteroaryl hydroxy compound that is pyridazin-3-ol substituted by an amino group at position 5 and a chloro group at position 4. It is a metabolite of the herbicide chloridazone. CONFIDENCE standard compound; EAWAG_UCHEM_ID 698

Desphenyl chloridazon

5-Amino-4-chloropyridazin-3(2H)-one

CONFIDENCE standard compound; INTERNAL_ID 2774 CONFIDENCE standard compound; INTERNAL_ID 4126

Indole-3-carboxaldehyde

INDOLE-3-CARBOXYALDEHYDE

Indole-3-carboxaldehyde (3-Formylindole), a banlangen extract, is the product of the oxidative degradation of indole-3-acetic acid (IAA) by crude enzyme preparations from etiolated pea seedlings. Indole-3-carboxaldehyde (3-Formylindole) is a biochemical used to prepare analogs of the indole phytoalexin cyclobrassinin[1]. Indole-3-carboxaldehyde (3-Formylindole), a banlangen extract, is the product of the oxidative degradation of indole-3-acetic acid (IAA) by crude enzyme preparations from etiolated pea seedlings. Indole-3-carboxaldehyde (3-Formylindole) is a biochemical used to prepare analogs of the indole phytoalexin cyclobrassinin[1].

indole-3-aldehyde

Indole-3-carboxaldehyde

indole-3-carbaldehyde

2-Hydroxyquinoline

4-Hydroxyquinoline

Annotation level-1

6-Quinolinol

6-Hydroxyquinoline

CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 69

Quinoline N-oxide

CONFIDENCE standard compound; INTERNAL_ID 2509

5-methanesulfinylpentanenitrile

Annotation level-3

8-HYDROXYQUINOLINE

CONFIDENCE standard compound; INTERNAL_ID 994; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4548; ORIGINAL_PRECURSOR_SCAN_NO 4543 CONFIDENCE standard compound; INTERNAL_ID 994; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3815; ORIGINAL_PRECURSOR_SCAN_NO 3813 CONFIDENCE standard compound; INTERNAL_ID 994; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4227; ORIGINAL_PRECURSOR_SCAN_NO 4222

Nudic Acid B

7-cyano-trans-2-Heptene-4,6-diynoic acid

4-formyl Indole

1H-Indole-4-carbaldehyde

4-(Chloromethyl)-2,5-dimethyl-1,3-oxazole

pyridazin-3-ylmethanamine hydrochloride

4-(1H-PYRAZOL-3-YL)PYRIDINE

7-chloroheptanonitrile

C7H12ClN (145.06582219999999)

4-Amino-3,5-difluorophenol

2-Pyridinemethanol,hydrochloride (1:1)

2(1H)-Pyrimidinone,4-amino-5-fluoro-1-methyl-

C5H8FN3O (145.065137)

4-Amino-6-chloro-5-pyrimidinol

1-(2-Pyrazinyl)methanamine hydrochloride (1:1)

PICOLINIC ACID SODIUM SALT

3-Ethynylbenzamide

5-(CHLOROMETHYL)-2,4-DIMETHYLOXAZOLE

3,5-Difluoro-2-hydrazinopyridine

Pyrido[3,4-d]pyrimidine, 4-methyl- (9CI)

Quinazolin-4-amine

Quinazolin-4-ylamine

COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

(3-Methylphenyl)(oxo)acetonitrile

2-ethenyl-1,3-benzoxazole

4-methylbenzoyl cyanide

(Aminooxy)benzene hydrochloride (1:1)

2,6-difluoropyridine-3,4-diamine

1,5-Naphthyridin-4-amine

2-Formyl-6-methylbenzonitrile

2-Chloro-3-fluoro-6-picoline

3-AMINO-3-(2-PYRIDINYL)ACRYLONITRILE

4-Chloro-3-fluoroaniline

2-Chloro-6-fluoroaniline

3,5-Difluoro-4-methoxypyridine

2-(Chloromethyl)-3-fluoropyridine

7-Quinazolinamine

2,6-Difluoro-4-hydrazinylpyridine

indolizine-2-carbaldehyde

Pyrido[2,3-b]pyrazine, 7-methyl- (9CI)

2-CYANO-2-PHENYLVINYLALCOHOL

1,8-Naphthyridin-2-amine

1,6-naphthyridin-2-amine

2,3-dihydro-1h-pyrrolo[2,3-b]pyridine-5-carbonitrile

Benzeneacetonitrile,2-formyl- (9CI)

(trimethylsilyl)methyl thiocyanate

C5H11NSSi (145.0381446)

3-ethyl-2-sulfanylidene-1,3-oxazolidin-4-one

5-Ethynyl-2-fluorobenzonitrile

C9H4FN (145.0327756)

1,1,2,2-Tetrafluoro-N,N-dimethylethanamine

C4H7F4N (145.051459)

3-Hydrazinopyridine hydrochloride (1:1)

(Diethyl-phosphinoyl)-acetonitrile

C6H12NOP (145.0656472)

Tetrahydro-2H-pyran-4-carbothioamide 90

3-Methyl-5-isoxazolecarbonyl chloride

6-amino-2,3-difluorophenol

4-Isoquinolinol

4,5-Dimethyl-thiazole-2-thiol

C5H7NS2 (145.0019902)

(R)-1-Amino-3-chloro-2-propanol hydrochloride

C3H9Cl2NO (145.0061164)

5-Methylisoxazole-3-carbonyl chloride

Indole-6-carboxaldehyde

2-AMINO-4,6-DIFLUOROPHENOL

2-Chloro-3-fluoro-5-methylpyridine

4-(1H-imidazol-2-yl)pyridine

4-Amino-2,3-difluorophenol

Pentanenitrile,5-chloro-2,2-dimethyl-

C7H12ClN (145.06582219999999)

1H-1,2,3-Triazole,1-phenyl-

4-FLUORO-2-AZABICYCLO[2.1.1]HEXANE-1-CARBOXYLIC ACID

C6H8FNO2 (145.053904)

2-Phenyloxazole

1,7-Naphthyridin-4-amine(9CI)

Pyrimidine, 2-(1H-pyrrol-1-yl)- (9CI)

Quinazoline, 5-amino- (6CI)

5-Chloro-3-fluoro-2-pyridinecarbonitrile

CINNOLIN-4-AMINE

Benzeneacetonitrile, a-(hydroxymethylene)-

4-Amino-1,2,5-thiadiazole-3-carboxylic acid

3-(2-pyridyl)pyrazole

Isoxazole, 5-phenyl-

3-Acetylbenzonitrile

1-phenyl-1H-1,2,4-triazole

2-IMIDAZOL-1-YL-PYRIDINE

2-Chloro-5-fluoro-4-methylpyridine

5-(Methoxymethyl)-1,3,4-thiadiazol-2-amine

4-Pyridazinemethanamine hydrochloride

METHYL 2-[(CYANOMETHYL)THIO]ACETATE

5-Amino-1,6-naphthyridine

6-Cinnolinamine

2(1H)-Pyridinone,6-(difluoromethyl)-(9CI)

3-Pyridinethiol,6-chloro-(9CI)

1-pyrazin-2-ylcyclopropane-1-carbonitrile

4-Isoxazolecarbonyl chloride, 3-methyl- (9CI)

2-(Chloromethyl)-6-fluoropyridine

2-methylpyridin-3-ol,hydrochloride

4-Chloro-5-fluoro-2-methylpyridine

3-aminophenol hydrochloride

4-METHYLOXAZOLE-5-CARBONYL CHLORIDE

5-(hydroxymethyl-d2)uracil-6-d1

C5H3D3N2O3 (145.056672134)

SODIUM 4-PYRIDINECARBOXYLATE TETRAHYDRATE

1,6-Naphthyridin-4-amine

8-Amino-1,7-naphthyridine

2,1,3-benzoxadiazole-5-carbonitrile

C7H3N3O (145.0276108)

5-(chloromethyl)-3-ethylisoxazole

(3-ISOPROPYL-4,5-DIHYDROISOXAZOL-5-YL)METHANOL

(2R,3S)-O,O-DIACETYL-3-DIBENZYLAMINO-5-METHYLHEXANE-1,2-DIOL

2-Amino-3,5-difluorophenol

2,5-Diaminopyridine hydrochloride

4-chloro-3-fluoro-2-methylpyridine

2,3,3,3-Tetrafluoropropionamide

C3H3F4NO (145.0150756)

Benzonitrile,4-formyl-2-methyl-(9CI)

Pyrido[3,4-b]pyrazine, 3-methyl- (7CI,8CI,9CI)

Isophthalaldehydonitrile, 5-methyl- (8CI)

4-chloro-1H-pyrrole-2-carboxylic acid

4-Amino-6-chloro-2(1H)-pyrimidinone

sodium nicotinate

P-CYANOACETOPHENONE

4-Acetylbenzonitrile

2-Chloro-4-fluoroaniline

6-cyanopurine

C6H3N5 (145.0388438)

2-Chloro-5-fluoro-3-methylpyridine

2-Chlor-3-fluor-4-methylpyridin

5-chloropyridine-2-thiol

2-Chloro-5-fluoroaniline

4(1H)-Pyrimidinone, 5-amino-6-chloro-

2-(1H-Pyrazol-4-yl)pyridine

4-(1H-Pyrazol-4-yl)pyridine

2-Amino-4,5-difluorophenol

2-Pyrimidinamine,4,6-difluoro-N-methyl-

(S)-1-Amino-3-chloro-2-propanol hydrochloride

C3H9Cl2NO (145.0061164)

4-PHENYLISOXAZOLE

3-Chloro-2-fluoro-5-methylpyridine

4-PHENYLOXAZOLE

Formamide, N,N,N-methylidynetris-

(3,5-difluoropyridin-2-yl)Methanol

6-Chloro-1,3,5-triazine-2,4-diamine

6-methylpyrido[2,3-b]pyrazine

4-Amino-5-chloro-3(2H)-pyridazinone

3-AMINO-5-ETHOXY-1,2,4-THIADIAZOLE

2-Chloro-3-fluoroaniline

4-Pyrimidinamine,2,6-difluoro-N-methyl-

2-Acetylbenzonitrile

2-Aminophenol hydrochloride

1,5-Naphthyridin-3-amine

1-ETHOXY-3-ISOTHIOCYANATO-PROPANE

4-Amino-2,5-difluorophenol

3-Chloro-5-fluoroaniline

3-Chloropyridine-2,4-diol

AI3-51930

(2-OXO-1,3-OXAZOLIDIN-3-YL)ACETICACID

7-Hydroxyisoquinoline

4-AMINO-ALPHA-[(TERT-BUTYLAMINO)METHYL]-3,5-DICHLOROBENZYLALCOHOL

cis-azetidine-2,4-dicarboxylic acid

1-bromo-1,1,2,2,3,3,4,4,4-nonadeuteriobutane

C4BrD9 (145.04525200199998)

3-Phenylisoxazole

2,6-Naphthyridin-1-amine(9CI)

3-CHLOROPYRIDINE-2-THIOL

6-Aminoquinazoline

5-Chloro-2-fluoro-3-methylpyridine

Phthalimide diimide

3-PHENYL-1H-1,2,4-TRIAZOLE

Methyl (4R)-2-oxo-1,3-oxazolidine-4-carboxylate

3-(2-Oxoethyl)benzonitrile

1,7-Naphthyridin-2-amine

4,5-Thiazoledimethanol

3-Isoquinolinol

6-Isoquinolinol

7-Isoquinolinol

Isoquinolin-8-ol

1,5-Naphthyridin-2-amine

6-Quinoxalinamine

Quinoxalin-6-amine

Quisqualamine

Pyridine, 3-(chloromethyl)-2-fluoro- (9CI)

(4,5-DIHYDRO-THIAZOL-2-YL)-O-TOLYL-AMINE

1,2,4-Benzotriazine, 3-methyl-

5-Formyl-2-methylbenzonitrile

5-Benzofurancarbonitrile,2,3-dihydro-(9CI)

3-Amino-1-iminio-1H-isoindolium

2-(4-chloro-1H-pyrazol-1-yl)ethanamine(SALTDATA: FREE)

4-Isoxazolecarbonylchloride, 5-methyl-

Pyridin-4-ylmethanol hydrochloride

2-Aminomethylpyrinidine hydrochloride

5-Quinoxalinamine

3-(1H-IMIDAZOL-2-YL)-PYRIDINE

4-Phenyl-1H-1,2,3-triazole

4-formyl-3-methylbenzonitrile

Ethyl N-(thioxomethylene)glycinate

4-(chloromethyl)-3,5-dimethylisoxazole

4-Chloro-2-fluoroaniline

5-Phenyloxazole

5-Phenyl-1,3-oxazole

5-Chloro-2-fluoroaniline

N-cyano-N-phenyl-methanimidamide

6-chloro-2-hydroxy-pyridazin-3-imine

4-PHENYL-4H-1,2,4-TRIAZOLE

2-(Chloromethyl)-5-fluoropyridine

Benzoylacetonitrile

3-Oxo-3-phenylpropanenitrile

hydroxy[(1-oxoallyl)amino]acetic acid

Pyridine, 5-(chloromethyl)-2-fluoro- (9CI)

Methyl 3-isothiocyanatopropionate

methyl 2-isothiocyanato propionate

3-Chloro-4-fluoroaniline

(s)-(-)-4-isopropyl-2-oxazolidinethione

1,8-naphthyridin-3-amine

Pyrido[2,3-b]pyrazine, 2-methyl- (9CI)

2-Amino-6-chloropyrimidin-4-ol

1,4-dithiane-2-carbonitrile

C5H7NS2 (145.0019902)

5-CHLORO-2-FLUORO-4-PICOLINE

pyridyl-pyrazole

3-Chloro-2-fluoroaniline

4-(Aminomethyl)pyrimidine hydrochloride

4-(aminomethyl)-pyrimidine hydrochloride

5-Hydroxyquinoline

3,5-Difluorpyridin-2,6-diamin

indolecarboxaldehyde

(+/-)-THIOPENTAL

4-NITROSOPHENOL SODIUM SALT 12 WT.

4(5H)-Thiazolone,2-amino-5-(aminomethyl)-

Cinnolin-4-ylamine

3-Amino-2,6-difluoro-phenol

3-CYANO-5-FLUOROPHENYLACETYLENE

C9H4FN (145.0327756)

Isoquinolin-4-ol

3-aminopyrazine-2,6-dicarbonitrile

C6H3N5 (145.0388438)

5-Nitrothiophen-2-ol

C4H3NO3S (144.9833648)

2-bromo-1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propane

C4BrD9 (145.04525200199998)

(2H5)Benzoyl chloride

C7ClD5O (145.03427689)

2-CHLOROPYRIDINE-4-THIOL

2,6-Difluoro-4-methoxypyridine

2-chloro-4-fluoro-5-methylpyridine

2-Hydrazinylpyridine Hydrochloride

2-Phenyl-1,2,3-triazole

4-cyanophenylacetaldehyde

1,7-Naphthyridin-6-amine(9CI)

5-Hydroxyisoquinoline

3-(1H-Pyrazol-3-yl)pyridine

6-MERCAPTO-1,2,4-TRIAZINE-3,5(2H,4H)-DIONE

6-Chloro-3-pyridinol 1-oxide

2-(Imidazol-2-yl)pyridine

4-Amino-2,6-difluorophenol

2-Aminoquinazoline

2-PICOLINE-N-OXIDE

2-bromobutane-d9

C4BrD9 (145.04525200199998)

4-NITROISOTHIAZOL-5-AMINE

8-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine

4-(1H-Imidazol-5-yl)pyridine

8-Methylpyrido[2,3-b]pyrazine

2,7-Naphthyridin-1-amine

2,6-difluoro-5-methylpyrimidin-4-amine

3-(5-Imidazolyl)pyridine

4-Hydrazinylpyridine hydrochloride

quinazolin-8-amine

5-Aminophthalazine

Quinoxalin-2-amine

1-Indolizinecarboxaldehyde

Pyrido[2,3-d]pyrimidine, 4-methyl- (8CI,9CI)

2,2,3,3-tetrafluoropropanamide

C3H3F4NO (145.0150756)

2-methylbenzoyl cyanide

6-Amino-2-chloropyrimidin-4(3H)-one

5-(Chloromethyl)-1,3-dimethyl-1H-1,2,4-triazole

6-Chloro-3-fluoro-2-methylpyridine

Quinolin-7-ol

7-Hydroxyquinoline

3-ETHYNYLPIPERIDINE HYDROCHLORIDE

C7H12ClN (145.06582219999999)

2-Hydroxy-5-oxoproline

1-Thiocarbamoyl-2-imidazolidinone

1H-Pyrido[3,2-c][1,2]diazepine

Pentanenitrile, 5-(methylsulfinyl)-

Promethium

Pm (145)

2-Oxoglutarate(1-)

A dicarboxylic acid monoanion resulting from selective deprotonation of the 1-carboxy group of 2-oxoglutaric acid. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

Cytosine glycol

L-glutamate(2-)

D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids

5-Fluoro-2-thiocytosine

C4H4FN3S (145.0109956)

Isoquinolin-3(4H)-one

Gimeracil

C471 - Enzyme Inhibitor > C2019 - Dihydropyrimidine Dehydrogenase Inhibitor

AI3-52407

5-21-08-00246 (Beilstein Handbook Reference)

Indole-4-carboxaldehyde

1H-Indole-4-carbaldehyde

(S)-2-acetyl-2-hydroxybutanoate

4-Hydroxy-3,3-dimethyl-2-oxobutanoate

3-Hydroxy-5-oxohexanoate

3-Oxo-3-ureidopropanoate

C4H5N2O4- (145.024931)

(R)-3-Hydroxy-3-methyl-2-oxopentanoate

The conjugate base of (R)-3-hydroxy-3-methyl-2-oxopentanoic acid and R enantiomer of 3-hydroxy-3-methyl-2-oxopentanoate.

4-Hydroxy-2-oxohexanoate

A medium-chain fatty acid anion comprising hexanoate substituted at C-2 and C-4 with oxo and hydroxy groups respectively.

Oxaloacetate 4-methyl ester

(S)-4-hydroxy-2-oxohexanoate

An optically active form of 4-hydroxy-2-oxohexanoate having 4S-configuration.

3-Hydroxy-3-methyl-2-oxopentanoate

The conjugate base of 3-hydroxy-3-methyl-2-oxopentanoic acid.

(R)-4-Dehydropantoate

(S)-4-amino-4,5-dihydro-2-thiophenecarboxylic acid

N-Methyl-DL-aspartate

(S)-4-amino-4,5-dihydro-2-thiophenecarboxylate

(R)-3-ureido-isobutyrate

5-Hydroxy-2,4-dioxopentanoate

(R)-mevaldate

3-Hydroxy-5-oxooxolane-3-carboxylate

methyl-carbamoyl-D-alanine

C4H3NO5-2 (145.00112280000002)

1-Carboxymalonamate

Glutamate(2-)

D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids

3-Ureidoisobutyrate(1-)

A monocarboxylic acid anion that is the conjugate base of 3-ureidoisobutyric acid, obtained by deprotonation of the carboxy group.

dehydro-D-arabinono-1,4-lactone(1-)

An organic anion that is the conjugate base of dehydro-D-arabinono-1,4-lactone, arising from selective deprotonation of the 3-hydroxy group; major species at pH 7.3.

Mevaldate

Adipate(1-)

C6H13O2Si- (145.06847779999998)

A dicarboxylic acid monoanion that is the conjugate base of adipic acid.

3-Trimethylsilylpropanoate

threo-3-methyl-L-aspartate(2-)

Metaborate

B3O7-5 (144.99232)

Glutaminate

An alpha-amino-acid anion that is the conjugate base of glutamine, arising from deprotonation of the carboxy group.

L-Glutaminate

An optically active form of glutaminate having L-configuration.

dehydro-L-arabinono-1,4-lactone(1-)

C4H3NO5-2 (145.00112280000002)

(2S)-2-nitrosobutanedioate

Nona-2,4,6-triynamide

D-Glutaminate

An optically active form of glutaminate having D-configuration.

(2R)-2-Aminopentanedioate

(S)-3-Hydroxy-3-methyl-2-oxopentanoate

The (S)-enantiomer of 3-hydroxy-3-methyl-2-oxopentanoate.

2-Hydroxy-5-oxopyrrolidine-2-carboxylic acid

(4S)-5,6-dihydro-4H-1,3-thiazine-4-carboxylic acid

(E)-4-hydroxy-3-nitropent-3-en-2-one

5-Nitrothiazol-2-amine

2-AMINO-5-NITROTHIAZOLE

C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent

4-quinolone

4-Hydroxyquinoline

Deethyldeisopropylatrazine

6-Chloro-1,3,5-triazine-2,4-diamine

1-Hydroxyisoquinoline

ISOQUINOLIN-1(2H)-ONE

COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

alpha-Ketoglutaramate

4-oxoglutaramic acid

3,4-Dehydrothiomorpholine-3-carboxylic acid

Diatretyne 2

L-glutamate(2-)

An L-alpha-amino acid anion that is the dianion obtained by the deprotonation of the both the carboxy groups of L-glutamic acid.

Glutamate(2-)

A dicarboxylic acid dianion that is the conjugate base of glutamate(1-).

D-glutamate(2-)

Quinolin-2(1H)-one

A quinolone that is 1,2-dihydroquinoline substituted by an oxo group at position 2.

Agrocybin

A triyne amide produced by the Brazilian fungus Agrocybe perfecta (Basidiomycota).

indole-4-carbaldehyde

A heteroarenecarbaldehyde that is indole in which the hydrogen at position 4 has been replaced by a formyl group.

2-dehydropantoate

C6H9O4 (145.0500814)

A 2-oxo monocarboxylic acid anion that results from the removal of a proton from the carboxylic acid group of 2-dehydropantoic acid.

Quinolin-2-ol

A monohydroxyquinoline carrying a hydroxy substituent at position 2. It is an intermediate metabolite produced duting the microbial degradation of quinoline.

threo-3-methyl-L-aspartate(2-)

2-Oxoglutaramic acid

Methyleneoxindole

Oxoglutaramic acid

Keto-glutaramic acid

Hydroxyquinoline

3-carboxy-n-methoxyprop-2-enimine oxide

7-cyanohept-2-en-4,6-diynoic acid

(e)-[(2e)-3-carboxyprop-2-en-1-ylidene](methoxy)oxidoazanium

1H-indole-3-carbonxal-dehyde

{"Ingredient_id": "HBIN002593","Ingredient_name": "1H-indole-3-carbonxal-dehyde","Alias": "NA","Ingredient_formula": "C9H7NO","Ingredient_Smile": "C1=CC=C2C(=C1)C(=CN2)C=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39629","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

3-aldehydoindole

{"Ingredient_id": "HBIN007888","Ingredient_name": "3-aldehydoindole","Alias": "NA","Ingredient_formula": "C9H7NO","Ingredient_Smile": "C1=CC=C2C(=C1)C(=CN2)C=O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "874","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

7-isoquinoli-nol