Exact Mass: 191.0735
Exact Mass Matches: 191.0735
Found 500 metabolites which its exact mass value is equals to given mass value 191.0735,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
5-Hydroxyindoleacetic acid
5-Hydroxyindoleacetic acid, also known as 5-hydroxyindole-3-acetate or 5-HIAA, belongs to the class of organic compounds known as indole-3-acetic acid derivatives. Indole-3-acetic acid derivatives are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole. 5-Hydroxyindoleacetic acid exists in all living organisms, ranging from bacteria to humans. In humans, 5-hydroxyindoleacetic acid is a breakdown product of serotonin that is excreted in the urine and it also participates in a number of enzymatic reactions. 5-hydroxyindoleacetic acid can be biosynthesized from 5-hydroxyindoleacetaldehyde; which is catalyzed by the mitochondrial enzyme aldehyde dehydrogenase. In addition, 5-hydroxyindoleacetic acid and S-adenosylmethionine can be converted into 5-methoxyindoleacetate and S-adenosylhomocysteine through its interaction with the enzyme acetylserotonin O-methyltransferase. 5-Hydroxyindoleacetic acid is also involved in the metabolism of tryptophan. 5-Hydroxyindoleacetic acid has been found to be associated with several human diseases such as brunner syndrome, friedreichs ataxia, schizophrenia, and olivopontocerebral atrophy; 5-hydroxyindoleacetic acid has also been linked to the inborn metabolic disorder sepiapterin reductase deficiency. Elevated levels of 5-hydroxyindoleacetic acid in urine (>20 uM) are indicative of appendicitis and gastroenteritis (PMID: 11462886). Serotonin and 5-Hydroxyindoleacetic acid are produced in excess amounts by carcinoid tumors, and levels of these substances may be measured in the urine to test for carcinoid tumors (NCI). 5-Hydroxyindoleacetic acid has also been found to be a product of human gut microbiota. 5-Hydroxyindoleacetic acid (5-HIAA) is the main metabolite of serotonin in the human body. In chemical analysis of urine samples, 5-HIAA is used to determine the bodys levels of serotonin. 5-Hydroxyindole-3-acetic acid is found in many foods, some of which are pitanga, dandelion, coconut, and white cabbage. 5-Hydroxyindole-3-acetic acid is the main metabolite of serotonin or metanephrines, which can be used as a biomarker of neuroendocrine tumors.
N-acetylmethionine
N-Acetyl-L-methionine or N-Acetylmethionine, belongs to the class of organic compounds known as N-acyl-alpha amino acids. N-acyl-alpha amino acids are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. N-Acetylmethionine can also be classified as an alpha amino acid or a derivatized alpha amino acid. Technically, N-Acetylmethionine is a biologically available N-terminal capped form of the proteinogenic alpha amino acid L-methionine. N-acetyl amino acids can be produced either via direct synthesis of specific N-acetyltransferases or via the proteolytic degradation of N-acetylated proteins by specific hydrolases. N-terminal acetylation of proteins is a widespread and highly conserved process in eukaryotes that is involved in protection and stability of proteins (PMID: 16465618). About 85\\\\% of all human proteins and 68\\\\% of all yeast proteins are acetylated at their N-terminus (PMID: 21750686). Several proteins from prokaryotes and archaea are also modified by N-terminal acetylation. The majority of eukaryotic N-terminal-acetylation reactions occur through N-acetyltransferase enzymes or NAT’s (PMID: 30054468). These enzymes consist of three main oligomeric complexes NatA, NatB, and NatC, which are composed of at least a unique catalytic subunit and one unique ribosomal anchor. The substrate specificities of different NAT enzymes are mainly determined by the identities of the first two N-terminal residues of the target protein. The human NatA complex co-translationally acetylates N-termini that bear a small amino acid (A, S, T, C, and occasionally V and G) (PMID: 30054468). NatA also exists in a monomeric state and can post-translationally acetylate acidic N-termini residues (D-, E-). NatB and NatC acetylate N-terminal methionine with further specificity determined by the identity of the second amino acid. N-acetylated amino acids, such as N-acetylmethionine can be released by an N-acylpeptide hydrolase from peptides generated by proteolytic degradation (PMID: 16465618). In addition to the NAT enzymes and protein-based acetylation, N-acetylation of free methionine can also occur. In particular, N-Acetylmethionine can be biosynthesized from L-methionine and acetyl-CoA by the enzyme methionine N-acetyltransferase (EC 2.3.1.66). Excessive amounts N-acetyl amino acids including N-acetylmethionine (as well as N-acetylglycine, N-acetylserine, N-acetylglutamine, N-acetylglutamate, N-acetylalanine, N-acetylleucine and smaller amounts of N-acetylthreonine, N-acetylisoleucine, and N-acetylvaline) can be detected in the urine with individuals with acylase I deficiency, a genetic disorder (PMID: 16465618). Aminoacylase I is a soluble homodimeric zinc binding enzyme that catalyzes the formation of free aliphatic amino acids from N-acetylated precursors. In humans, Aminoacylase I is encoded by the aminoacylase 1 gene (ACY1) on chromosome 3p21 that consists of 15 exons (OMIM 609924). Individuals with aminoacylase I deficiency will experience convulsions, hearing loss and difficulty feeding (PMID: 16465618). ACY1 can also catalyze the reverse reaction, the synthesis of acetylated amino acids. Many N-acetylamino acids, including N-acetylmethionine are classified as uremic toxins if present in high abundance in the serum or plasma (PMID: 26317986; PMID: 20613759). Uremic toxins are a diverse group of endogenously produced molecules that, if not properly cleared or eliminated by the kidneys, can cause kidney damage, cardiovascular disease and neurological deficits (PMID: 18287557). Nutrient supplement used as a source of L-methionine. KEIO_ID A065 N-Acetyl-DL-methionine is an endogenous metabolite. N-Acetyl-L-methionine, a human metabolite, is nutritionally and metabolically equivalent to L-methionine. L-methionine is an indispensable amino acid required for normal growth and development[1].
Carbendazim
CONFIDENCE standard compound; INTERNAL_ID 581; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5355; ORIGINAL_PRECURSOR_SCAN_NO 5354 CONFIDENCE standard compound; INTERNAL_ID 581; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5355; ORIGINAL_PRECURSOR_SCAN_NO 5353 CONFIDENCE standard compound; INTERNAL_ID 581; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5335; ORIGINAL_PRECURSOR_SCAN_NO 5333 CONFIDENCE standard compound; INTERNAL_ID 581; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5352; ORIGINAL_PRECURSOR_SCAN_NO 5350 CONFIDENCE standard compound; INTERNAL_ID 581; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5299; ORIGINAL_PRECURSOR_SCAN_NO 5297 CONFIDENCE standard compound; INTERNAL_ID 581; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5335; ORIGINAL_PRECURSOR_SCAN_NO 5330 C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics CONFIDENCE standard compound; EAWAG_UCHEM_ID 278 Systemic agricultural and horticultural fungicid CONFIDENCE standard compound; INTERNAL_ID 8792 CONFIDENCE standard compound; INTERNAL_ID 2861 CONFIDENCE standard compound; INTERNAL_ID 4050 D009676 - Noxae > D009153 - Mutagens D016573 - Agrochemicals D010575 - Pesticides KEIO_ID C170
5-Phenyl-1,3-oxazinane-2,4-dione
5-Phenyl-1,3-oxazinane-2,4-dione is a metabolite of felbamate. Felbamate (marketed under the brand name Felbatol by MedPointe) is an anti-epileptic drug used in the treatment of epilepsy. It is used to treat partial seizures (with and without generalization) in adults and partial and generalized seizures associated with Lennox-Gastaut syndrome in children. However, an increased risk of potentially fatal aplastic anemia and/or liver failure limit the drugs usage to severe refractory epilepsy. (Wikipedia)
(2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid
D006133 - Growth Substances > D010937 - Plant Growth Regulators > D007210 - Indoleacetic Acids
xi-2,3-Dihydro-2-oxo-1H-indole-3-acetic acid
xi-2,3-Dihydro-2-oxo-1H-indole-3-acetic acid is found in brassicas. xi-2,3-Dihydro-2-oxo-1H-indole-3-acetic acid is isolated from Ribes rubrum (currant), Brassica species and Helianthus annuus (sunflower). xi-2,3-Dihydro-2-oxo-1H-indole-3-acetic acid is a product of catabolism of 1H-Indole-3-acetic acid
Calystegine C1
Alkaloid from Morus alba (white mulberry) and Lycium chinense (Chinese boxthorn). Calystegine C1 is found in many foods, some of which are tea, coffee and coffee products, fruits, and herbs and spices. Calystegine C2 is found in coffee and coffee products. Calystegine C2 is an alkaloid from Lycium chinense (Chinese boxthorn).
4-Hydroxycitrulline
4-Hydroxycitrulline is found in pulses. 4-Hydroxycitrulline is isolated from Vicia fab
1-Isothiocyanato-4-phenylbutane
1-Isothiocyanato-4-phenylbutane is found in brassicas. Present as the glucosinolate in Armoracia lapathifolia (horseradish). Present as the glucosinolate in Armoracia lapathifolia (horseradish). 1-Isothiocyanato-4-phenylbutane is found in brassicas.
2-Butylbenzothiazole
2-Butylbenzothiazole is found in nuts. 2-Butylbenzothiazole is a flavour component in roasted coconut and cashew nuts. Flavour component in roasted coconut and cashew nuts. 2-Butylbenzothiazole is found in nuts.
Dihydro-6-isopropyl-2,4-dimethyl-4H-1,3,5-dithiazine
Dihydro-6-isopropyl-2,4-dimethyl-4H-1,3,5-dithiazine is found in mollusks. Dihydro-6-isopropyl-2,4-dimethyl-4H-1,3,5-dithiazine is isolated from dried squid aroma. Dihydro-6-isopropyl-2,4-dimethyl-4H-1,3,5-dithiazine is a flavouring ingredient. Isolated from dried squid aroma. Flavouring ingredient. Dihydro-6-isopropyl-2,4-dimethyl-4H-1,3,5-dithiazine is found in mollusks.
Dihydro-4,6-dimethyl-2-(1-methylethyl)-4H-1,3,5-dithiazine
Dihydro-4,6-dimethyl-2-(1-methylethyl)-4H-1,3,5-dithiazine is found in mollusks. Dihydro-4,6-dimethyl-2-(1-methylethyl)-4H-1,3,5-dithiazine is isolated from dried squid aroma. Dihydro-4,6-dimethyl-2-(1-methylethyl)-4H-1,3,5-dithiazine is a flavouring ingredient. Isolated from dried squid aroma. Flavouring ingredient. Dihydro-4,6-dimethyl-2-(1-methylethyl)-4H-1,3,5-dithiazine is found in mollusks.
L-quinate
L-quinate, also known as L-quinic acid, belongs to quinic acids and derivatives class of compounds. Those are compounds containing a quinic acid moiety (or a derivative thereof), which is a cyclitol made up of a cyclohexane ring that bears four hydroxyl groups at positions 1,3.4, and 5, as well as a carboxylic acid at position 1. L-quinate is very soluble (in water) and a weakly acidic compound (based on its pKa). L-quinate can be found in a number of food items such as fireweed, yellow wax bean, japanese walnut, and black cabbage, which makes L-quinate a potential biomarker for the consumption of these food products. Quinic acid is a cyclitol, a cyclic polyol, and a cyclohexanecarboxylic acid. It is a crystalline acid obtained from cinchona bark, coffee beans, and other plant products and made synthetically by hydrolysis of chlorogenic acid. Quinic acid is also implicated in the perceived acidity of coffee. It is a constituent of the tara tannins .
3-urfuryl 2-yrrolecarboxylate
Furan-3-ylmethyl 1H-pyrrole-2-carboxylate is a natural product found in Pseudostellaria heterophylla with data available.
3-Furfuryl
Furan-3-ylmethyl 1H-pyrrole-2-carboxylate is a natural product found in Pseudostellaria heterophylla with data available.
4-oxo-1,2,3,4-tetrahydroquinoline-2-carboxylic acid
2-((2R,3R,4R)-3,4-dihydroxy-2-(hydroxymethyl)pyrrolidin-1-yl)acetic acid|DAB-N-ethanoic acid
Di-Me ester,hydrochloride-2-Amino-3-hydroxypentanedioic acid
Arecoline HCl
5-Hydroxyindole-3-acetic acid
D006133 - Growth Substances > D010937 - Plant Growth Regulators > D007210 - Indoleacetic Acids IPB_RECORD: 561; CONFIDENCE confident structure 5-Hydroxyindole-3-acetic acid is the main metabolite of serotonin or metanephrines, which can be used as a biomarker of neuroendocrine tumors.
L-thiocitrulline
D004791 - Enzyme Inhibitors relative retention time with respect to 9-anthracene Carboxylic Acid is 0.053 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.051 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.052
5-Hydroxyindoleacetate
5-Hydroxyindole-3-acetic acid is the main metabolite of serotonin or metanephrines, which can be used as a biomarker of neuroendocrine tumors.
5-Hydroxyindoleacetic acid
5-Hydroxyindole-3-acetic acid is the main metabolite of serotonin or metanephrines, which can be used as a biomarker of neuroendocrine tumors.
N-acetyl-L-methionine
An L-methionine derivative that is L-methionine in which one of the amine hydrogens is substituted by an acetyl group. N-Acetyl-L-methionine, a human metabolite, is nutritionally and metabolically equivalent to L-methionine. L-methionine is an indispensable amino acid required for normal growth and development[1].
Carbendazim
A member of the class of benzimidazoles that is 2-aminobenzimidazole in which the primary amino group is substituted by a methoxycarbonyl group. A fungicide, carbendazim controls Ascomycetes, Fungi Imperfecti, and Basidiomycetes on a wide variety of crops, including bananas, cereals, cotton, fruits, grapes, mushrooms, ornamentals, peanuts, sugarbeet, soybeans, tobacco, and vegetables. C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics D009676 - Noxae > D009153 - Mutagens D016573 - Agrochemicals D010575 - Pesticides
Dimethylisopropyldihydro-1,3,5-dithiazine
2-isopropyl-4,6-dimethyl-1,3,5-dithiazinane
1,2,3,4-Tetrahydro-2-oxo-quinoline-8-carboxylic acid
1H-Indazole-1-carboxylicacid,6-amino-,methylester(9CI)
5-AMINO-1H-INDAZOLE-7-CARBOXYLIC ACID METHYL ESTER
1H-Benzimidazole-1-carboxamide,2,3-dihydro-N-methyl-2-oxo-(9CI)
2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-7-CARBOXYLIC ACID
methyl 6-amino-1H-pyrrolo[3,2-b]pyridine-2-carboxylate
1H-Indazole-1-carboxylicacid,4-amino-,methylester(9CI)
5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid
1-(2-FLUORO-BENZYL)-1H-PYRAZOL-4-YLAMINE
5-Amino-1H-indazole-3-carboxylic acid methyl ester
Cyclopropanecarboxylic acid, 1-amino-2-ethenyl-, ethyl ester, hydrochloride (9CI)
Pyrido[2,3-b]pyrazine, 2,3-dimethyl-, 1,4-dioxide (9CI)
2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxylic acid
(E)-(-)-octahydrocyclopenta(b)pyrrole-2-carboxylic acid hydrochloride
3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
N-Acetyl-D-methionine
An N-acetyl-D-amino acid in which the amino acid is D-methionine.
1H-Pyrazolo[3,4-b]pyridine-3-carboxylicacid,ethylester
amino-6,6-difluoro-bicyclo[3.1.0]hexane-3-acetic acid
2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-3-CARBOXYLIC ACID
n-[5-(trifluoromethyl)pyrid-2-yl]-n-methylhydrazine
2-Propenoic acid,2-cyano-3-(2-furanyl)-, ethyl ester
2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid(SALTDATA: FREE)
N-Acetyl-D-penicillamine
N-Acetylpenicillamine is acompounds derived from the amino acid penicillamine.
Cyclopropanecarboxylic acid, 1-amino-2-ethenyl-, ethyl ester, hydrochloride (1:1),(1R,2S)-rel-
(4-HYDROXY-3-METHOXY-PHENYL)-MORPHOLIN-4-YL-METHANETHIONE
2,6-dimethylimidazo[1,2-a]pyrazine-3-carboxylic acid
2-AMINO-IMIDAZO[1,2-A]PYRIDINE-6-CARBOXYLIC ACID METHYL ESTER
1H-Benzimidazole-5-carboxylicacid,6-amino-,methylester
2-(Trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
Hydrazinecarbothioamide, 2-(2,2-dimethoxy-1-methylethylidene)-
Pyrido[3,4-b]pyrazine-2,3-dione, 1-ethyl-1,4-dihydro- (9CI)
2-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
Methyl 8-aminoimidazo[1,2-a]pyridine-6-carboxylate
Pyrido[2,3-b]pyrazine-2,3-dione, 4-ethyl-1,4-dihydro- (9CI)
2-(1-METHYLHYDRAZINYL)-3-(TRIFLUOROMETHYL)PYRIDINE
1,2,3,4-TETRAHYDRO-NAPHTHALENE-1-CARBOTHIOIC ACID AMIDE
2-Oxo-1,2,3,4-tetrahydroquinoline-6-carboxylic acid
Pyrido[2,3-b]pyrazine-2,3-dione, 1,4-dihydro-1,4-dimethyl- (9CI)
4,4-dimethyl-2,6-dioxopiperidine-3,5-dicarbonitrile
1-Allylpyrrolidine-2-carboxylic acid hydrochloride
N-(CYCLOHEXYLMETHYL)(TETRAHYDRO-2-FURANYL)-METHANAMINE
3-amino-N,N-dimethyl-1H-1,2,4-triazole-5-carboxamide(SALTDATA: 0.8H2O 0.06SiO2)
Pyrido[3,4-b]pyrazine-2,3-dione, 1,4-dihydro-1,4-dimethyl- (9CI)
5-[4-(aminomethyl)phenyl]-3H-1,3,4-oxadiazol-2-one
1H-Benzimidazole-5-carboxylicacid,1-amino-2-methyl-(9CI)
5-(DiMethylaMinoMethyl)furfuryl alcohol hydrochloride
Pyrido[2,3-b]pyrazine-2,3-dione, 1,4-dihydro-6,8-dimethyl- (9CI)
5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Scopine hydrochloride
Scopine hydrochloride (6,7-Epoxytropine hydrochloride) is the metabolite of anisodine, which is a α1-adrenergic receptor agonist and used in the treatment of acute circulatory shock. Scopine hydrochloride (6,7-Epoxytropine hydrochloride) is the metabolite of anisodine, which is a α1-adrenergic receptor agonist and used in the treatment of acute circulatory shock.
3-(1-methylpyrrol-2-yl)-1H-pyrazole-5-carboxylic acid
8-methyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-6-carbaldehyde
6-Benzoxazolecarboxylic acid, 2-Methyl-, Methyl ester
methyl 2-methylimidazo[1,2-a]pyrimidine-3-carboxylate
1H-1,2,3-benzotriazole-5-carboxylic acid, 7-Methyl-, Methyl ester
8-OXO-5,6,7,8-TETRAHYDROQUINOLINE-2-CARBOXYLIC ACID
IMidazo [1,2-B] pyrazin-3-carboxylic acid ethyl ester
Trans-1H-Indene-2-carboxylicacid,1-amino-2,3-dihydro-,ethylester
(3R)-3-amino-2,3-dihydro-1H-indene-5-carboxylic acid methyl ester
Imeglimin hydrochloride
Imeglimin hydrochloride (EMD 387008) is an oral glucose-lowering agent. Imeglimin also reduces reactive oxygen species (ROS) production, increases mitochondrial DNA and improves mitochondrial function[1].
1H-Benzimidazole-5-carboxylicacid,1-amino-,methylester
diendo-3-Amino-bicyclo[2.2.1]heptane-2-carboxylic acid hydrochloride
Ethanone, 1-[(2S)-2,3-dihydro-2-(hydroxyMethyl)-1H-indol-1-yl]-
methyl 5-amino-1H-pyrrolo[2,3-b]pyridine-3-carboxylate
OCTAHYDRO-CYCLOPENTA[C]PYRROLE-1-CARBOXYLIC ACID HYDROCHLORIDE
1-(6-methoxypyrazolo[1,5-b]pyridazin-3-yl)ethanone
(R)-1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXYLIC ACID METHYL ESTER
Cyclopropanecarboxylic acid, 1-amino-2-ethenyl-, ethyl ester, hydrochloride (1:1), (1R,2S)-
IMIDAZO[1,2-A]PYRAZINE-8-CARBOXYLIC ACID ETHYL ESTER
2H-1-Benzopyran-2-one, 8-amino-7-hydroxy-4-methyl-
N-(1-hydrazinyl-1-oxo-4-sulfanylbutan-2-yl)acetamide
methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate
5,7-Dimethylimidazo[1,2-a]pyrimidine-2-carboxylic acid
(1S,3aR,6aS)-Octahydrocyclopenta[c]pyrrole-1-carboxylic acid hydrochloride
METHYL 3-METHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLATE
(R)-2-Amino-2-(2,3-dihydro-1H-inden-2-yl)acetic acid
Phenol, 2-[[3-hydroxy-1-methyl-2-buten-1-ylidene]amino]-
1,3-Dimethylpyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
1,3-Dimethylpyrido[3,2-d]pyrimidine-2,4(1H,3H)-dione
1,3-Dimethylpyrido[3,4-d]pyrimidine-2,4(1H,3H)-dione
3-Ethyl-1,3-dihydro-3-methoxy-2H-indol-2-one
An oxindole that is 1,3-dihydro-2H-indol-2-one which is substituted by ethyl and methoxy groups at position 3.
(2S,4R,5S)-2-ammonio-4,5-dihydroxy-6-oxoheptanoate
(1R,3R,4S,5R)-1,3,4-Trihydroxy-5-aminocyclohexanecarboxylic acid
4-(1,2,3,6-Tetrahydropyridin-4-yl)benzene-1,2-diol
SureCN668028
A nitrile that is phenylacetonitrile substituted by a carboxy and a methoxy group at positions 1 and 3 respectively.
2-hydroxy-(indol-3-yl)acetic acid
A member of the class of indole-3-acetic acids that is indole-3-acetic acid in which the hydrogen at position 2 has been replaced by a hydroxy group. This is a very minor tautomer; the major tautomer is the corresponding oxindole.
2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid zwitterion
Zwitterionic form of 2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid.
5-methoxyindole-2-carboxylic acid
An indolecarboxylic acid that is indole-2-carboxylic acid carrying an additional methoxy substituent at position 5.
(5-hydroxyindol-3-yl)acetic acid
A member of the class of indole-3-acetic acids that is indole-3-acetic acid substituted by a hydroxy group at C-5.
2-amino-2,3,7-trideoxy-D-lyxo-hept-6-ulosonic acid
A ketoaldonic acid derivative derivative that is a seven-membered ketoaldonic acid having an amino substituent at the 2-position and the 3- and 7-positions deoxygenated.
2-Oxindole-3-acetic acid
A member of the class of oxindoles that is 2-oxindole carrying a carboxymethyl substituent at position 3.
2-Amino-2,3,7-trideoxy-D-threo-hept-6-ulosonic acid
4-(prop-2-en-1-yl)-5h,6h,7h-cyclopenta[c]pyridine-1,5-diol
(2s,4s)-2-amino-4-hydroxy-5-(c-hydroxycarbonimidoylamino)pentanoic acid
n-(1h-1,3-benzodiazol-2-yl)methoxycarboximidic acid
(1r,9s)-12-methyl-6-oxa-12-azatricyclo[7.2.1.0²,⁷]dodeca-2(7),4-dien-3-one
(2s)-2-[(1-hydroxyethylidene)amino]-4-(methylsulfanyl)butanoic acid
1,2,3,4,7-pentahydroxy-6-nitrobicyclo[3.3.0]-octane
{"Ingredient_id": "HBIN000578","Ingredient_name": "1,2,3,4,7-pentahydroxy-6-nitrobicyclo[3.3.0]-octane","Alias": "NA","Ingredient_formula": "C7H13NO5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16843","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-azabicyclo[3.2.1]octane-1,2,3,4,6-pentol; (1r*,2r*,3r*,4s*,6r*)-form
{"Ingredient_id": "HBIN013639","Ingredient_name": "8-azabicyclo[3.2.1]octane-1,2,3,4,6-pentol; (1r*,2r*,3r*,4s*,6r*)-form","Alias": "NA","Ingredient_formula": "C7H13NO5","Ingredient_Smile": "NA","Ingredient_weight": "191.18","OB_score": "NA","CAS_id": "190957-44-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7381","PubChem_id": "NA","DrugBank_id": "NA"}
