Exact Mass: 202.08728499999998
Exact Mass Matches: 202.08728499999998
Found 500 metabolites which its exact mass value is equals to given mass value 202.08728499999998,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Vasicinone
C11H10N2O2 (202.07422400000002)
Vasicinone is a member of quinazolines. Vasicinone is a natural product found in Justicia adhatoda, Anisotes trisulcus, and other organisms with data available. Vasicinone is a quinazoline alkaloid isolated from the Adhatoda vasica. Vasicinone is a potential agent for Parkinson's disease and possibly other oxidative stress-related neurodegenerative disorders[1].
Goltix
CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6698; ORIGINAL_PRECURSOR_SCAN_NO 6696 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6758; ORIGINAL_PRECURSOR_SCAN_NO 6757 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3205; ORIGINAL_PRECURSOR_SCAN_NO 3203 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3208; ORIGINAL_PRECURSOR_SCAN_NO 3206 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6726; ORIGINAL_PRECURSOR_SCAN_NO 6725 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6740; ORIGINAL_PRECURSOR_SCAN_NO 6738 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6706; ORIGINAL_PRECURSOR_SCAN_NO 6705 CONFIDENCE standard compound; INTERNAL_ID 919; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6743; ORIGINAL_PRECURSOR_SCAN_NO 6739 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 83 CONFIDENCE standard compound; EAWAG_UCHEM_ID 58 CONFIDENCE standard compound; INTERNAL_ID 4017 CONFIDENCE standard compound; INTERNAL_ID 8401 CONFIDENCE standard compound; INTERNAL_ID 2316 CONFIDENCE standard compound; INTERNAL_ID 3538
1-Methyl-2-nitro-3-((tetrahydrofuran-3-yl)methyl)guanidine
CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2265; ORIGINAL_PRECURSOR_SCAN_NO 2263 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4882; ORIGINAL_PRECURSOR_SCAN_NO 4880 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2272; ORIGINAL_PRECURSOR_SCAN_NO 2269 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2332; ORIGINAL_PRECURSOR_SCAN_NO 2331 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4896; ORIGINAL_PRECURSOR_SCAN_NO 4892 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4897; ORIGINAL_PRECURSOR_SCAN_NO 4894 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4897; ORIGINAL_PRECURSOR_SCAN_NO 4895 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2287; ORIGINAL_PRECURSOR_SCAN_NO 2286 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2295; ORIGINAL_PRECURSOR_SCAN_NO 2291 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4888; ORIGINAL_PRECURSOR_SCAN_NO 4886 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4868; ORIGINAL_PRECURSOR_SCAN_NO 4865 CONFIDENCE standard compound; INTERNAL_ID 1334; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2275; ORIGINAL_PRECURSOR_SCAN_NO 2273 Dinotefuran is an insecticide of the neonicotinoid class, its mechanism of action involves disruption of the insect's nervous system by inhibiting nicotinic acetylcholine receptors. Target: nAChR, Antiparasitic
Pyrene
Pyrene is a polycyclic aromatic hydrocarbon (PAH) consisting of four fused benzene rings, resulting in a flat aromatic system. The chemical formula is C16H10. This colourless solid is the smallest peri-fused PAH (one where the rings are fused through more than one face). Pyrene forms during incomplete combustion of organic compounds. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes
Diethyl oxalpropionate
Diethyl oxalpropionate, also known as methyloxalacetic acid diethyl ester or diethyl methyloxalacetate, is a member of the class of compounds known as beta-keto acids and derivatives. These compounds are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom. Diethyl oxalpropionate is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Within the cell, diethyl oxalpropionate is primarily located in the cytoplasm. Diethyl oxalpropionate is an intermediate for poly((R,S)-3,3-dimethylmalic acid) (PDMMLA) derivative synthesis. PDMMLA derivative can be used in synthesis of nanoparticles and study of warfarin encapsulation and controlled release[1].
L-Coprine
L-Coprine is found in mushrooms. L-Coprine is present in the moderately toxic ink cap mushroom Coprinus atramentarius (common ink cap). Produces an oversensitivity to ethanol in some people Present in the mod. toxic ink cap mushroom Coprinus atramentarius (common ink cap). Produces an oversensitivity to ethanol in some people. L-Coprine is found in mushrooms.
6-Acetyl-2,2-dimethyl-2H-1-benzopyran
6-Acetyl-2,2-dimethyl-2H-1-benzopyran is a 1-benzopyran. 1-(2,2-Dimethylchromen-6-yl)ethanone is a natural product found in Ageratina altissima, Viguiera pazensis, and other organisms with data available. 6-Acetyl-2,2-dimethyl-2H-1-benzopyran is found in fats and oils. 6-Acetyl-2,2-dimethyl-2H-1-benzopyran is a constituent of Helianthus annuus (sunflower) Constituent of Helianthus annuus (sunflower). 6-Acetyl-2,2-dimethyl-2H-1-benzopyran is found in sunflower and fats and oils. Demethoxyencecalin is a chromene isolated from Helianthus annuus, has antifungal activities[1].
Tetrahydroharmol
Tetrahydroharmol is found in fruits. Tetrahydroharmol is an alkaloid from Elaeagnus angustifolia (Russian olive) Harmaline is a reversible inhibitor of MAO-A (RIMA). Harmine is a reversible inhibitor of MAO-A (RIMA). It is important to note that unlike synthetic pharmaceutical MAOIs such as phenelzine, harmine is reversible and selective meaning it does not have nearly as high a risk for the "cheese syndrome" caused by consuming tyramine-containing foods, which is a risk associated with monoamine oxidase A inhibitors, but not monoamine oxidase B inhibitors. Several alkaloids that function as monoamine oxidase inhibitors (MAOIs) are found in the seeds of Peganum harmala (also known as Harmal or Syrian Rue), including harmine, harmaline, and harmalol, which are members of a group of substances with a similar chemical structure collectively known as harmala alkaloids. These alkaloids are of interest for their use in Amazonian shamanism, where they are derived from other plants. The harmala alkaloid harmine which was once known as Telepathine and Banisterine is a naturally occurring beta-carboline alkaloid that is structurally related to harmaline, and also found in the vine Banisteriopsis caapi. Tetrahydroharmine is also found in B. caapi, but not P. harmala. Dr. Alexander Shulgin has suggesed that harmaline may be a breakdown product of harmine. Harmine and harmaline are reversible MAOIs of the MAO-A isoform of the enzyme, and can stimulate the central nervous system by inhibiting the metabolism of monoamine compounds such as serotonin and norepinephrine. The harmala alkaloids occur in Peganum harmala in concentrations of roughly 3\\%, though tests have documented anywhere from 2-7\\%, as natural sources tend to vary widely in chemical makeup. Harmala alkaloids are also found in the Banisteriopsis caapi vine, the key plant ingredient in the sacramental beverage Ayahuasca, in concentrations that range between 0.31-8.43\\% for harmine, 0.03-0.83\\% for harmaline and 0.05-2.94\\% for tetrahydroharmine. Other psychoactive plants are often added to Ayahuasca to achieve visionary states of consciousness; for example leaves from Psychotria viridis, which is a source of dimethyltryptamine (DMT). The harmala alkaloids serve to potentiate these brewed compounds by preventing their breakdown in the digestive tract. The harmala alkaloids are not especially psychoactive on their own, even at high dosages, when vomiting and diarrhea become the main effect
Prolyl-Serine
Prolyl-Serine is a dipeptide composed of proline and serine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Alanylhydroxyproline
Alanylhydroxyproline is a dipeptide composed of alanine and hydroxyproline. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Hydroxyprolyl-Alanine
Hydroxyprolyl-Alanine is a dipeptide composed of hydroxyproline and alanine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Serylproline
Serylproline is a dipeptide composed of serine and proline. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
3-(3-Methylbutylidene)-1(3H)-isobenzofuranone
Minor odorous constituent of celery (Apium graveolens). 3-(3-Methylbutylidene)-1(3H)-isobenzofuranone is found in wild celery and green vegetables. 3-(3-Methylbutylidene)-1(3H)-isobenzofuranone is found in green vegetables. Minor odorous constituent of celery (Apium graveolens
N-Methyl-1H-indole-3-propanamide
N-Methyl-1H-indole-3-propanamide is found in mushrooms. N-Methyl-1H-indole-3-propanamide is produced by Omphalotus olearius (common chanterelle). Production by Omphalotus olearius (common chanterelle). N-Methyl-1H-indole-3-propanamide is found in mushrooms.
3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid
3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid is found in fats and oils. 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid is a constituent of olives (Olea europaea). Constituent of olives (Olea europaea). 3-(1-Hydroxymethyl-1-propenyl)pentanedioic acid is found in fats and oils, herbs and spices, and fruits.
2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine
2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine is found in animal foods. 2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine is isolated from cooked meat Isolated from cooked meats. 2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine is found in animal foods.
6-Methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
VASICINONE
C11H10N2O2 (202.07422400000002)
6-Hydroxy-3,4-dihydro-1-oxo-beta-carboline
C11H10N2O2 (202.07422400000002)
6-Hydroxy-1-methyl-1,2,3,4-tetrahydro-beta-carboline
Benzenemethanol, 3-(1H-imidazol-4-ylmethyl)-2-methyl-
4-amino-2-methylquinoline-6-carboxylic acid
C11H10N2O2 (202.07422400000002)
2,3-O-Isopropylidene-beta-D-Pyranose-1,6-Anhydromannose
(-)-(S,S)-Bisseton|(-)-bissetone|(2S,5S)-5-acetonyl-5-hydroxy-2-hydroxymethyltetrahydropyran-4-one|bissetone
4-Acetyl-2-(3-methyl-1,3-butadienyl)phenol|4-Hydroxy-3-<3-methyl-butadien-(1,3)-yl>-acetophenon
(+)-trideca-1,5t,11t-triene-7,9-diyne-3,4-diol|1,5,11-Tridecatriene-7,9-diyne-3,4-diol
3-methyl-7-(methylamino)isoquinoline-5,8-dione
C11H10N2O2 (202.07422400000002)
(2S)-Tridec-trans-3-en-5.7.9-triin-1.2-diol|(S)-(E)-3-Tridecene-5,7,9-triyne-1,2-diol|(S)-tridec-3t-ene-5,7,9-triyne-1,2-diol
1-Methyl-2,7-naphthyridine-4-carboxylic acid methyl ester
C11H10N2O2 (202.07422400000002)
6-METHOXY-1,2,3,4-TETRAHYDRO-BETA-CARBOLINE
D002491 - Central Nervous System Agents > D000927 - Anticonvulsants
1,2-O-Isopropylidene,3,4-anhydro-beta-D-Tagatose,,
1-Methyl-4,5-dihydropyrrolo[4,3,2-de]quinoline-7,8-dione
C11H10N2O2 (202.07422400000002)
5-hydroxy-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
C11H10N2O2 (202.07422400000002)
1-Alcohol,Me ester-4-Hydroxy-3-(3-methyl-3-buten-1-ynyl)benzoic acid|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|4-methoxy-3-(3-methylbut-3-en-1-ynyl)benzyl alcohol|eutypinol|methyleutypinol
Dinotefuran
D010575 - Pesticides > D007306 - Insecticides > D000073943 - Neonicotinoids D016573 - Agrochemicals CONFIDENCE standard compound; EAWAG_UCHEM_ID 3108 Dinotefuran is an insecticide of the neonicotinoid class, its mechanism of action involves disruption of the insect's nervous system by inhibiting nicotinic acetylcholine receptors. Target: nAChR, Antiparasitic
Pro-ser
A dipeptide formed from L-proline and L-serine residues.
Ser-pro
A dipeptide formed from L-serine and L-proline residues.
Demethoxyencecalin
Demethoxyencecalin is a chromene isolated from Helianthus annuus, has antifungal activities[1].
2-Amino-1,6-dimethylfuro[3,2-e]imidazo[4,5-b]pyridine
1,8-Naphthyridine-2-carboxylicacid,ethylester(9CI)
C11H10N2O2 (202.07422400000002)
C-[3-(3,5-DIMETHYL-PHENYL)-ISOXAZOL-5-YL]-METHYLAMINE
2-methyl-4-nitro-naphthalen-1-amine
C11H10N2O2 (202.07422400000002)
6-(4-METHOXYPHENYL)PYRIDAZIN-3(2H)-ONE
C11H10N2O2 (202.07422400000002)
(S)-2-CYCLOPENTYLOXYCARBONYLAMINO-3,3-DIMETHYL-BUTYRICACID
5(4H)-Oxazolone,2-ethyl-4-(3-pyridinylmethylene)-(9CI)
C11H10N2O2 (202.07422400000002)
2-Trifluoromethyl-5,6,7,8-tetrahydro-[1,6]naphthyridine
3-Amino-2-methyl-4-quinolinecarboxylic acid
C11H10N2O2 (202.07422400000002)
6-Quinoxalinecarboxylicacid, 2,3-dimethyl-
C11H10N2O2 (202.07422400000002)
Methyl 5-phenyl-1H-pyrazole-3-carboxylate
C11H10N2O2 (202.07422400000002)
4-(1-METHYL-5-IMIDAZOLYL)BENZOIC ACID
C11H10N2O2 (202.07422400000002)
3-(dimethylamino)-2-(4-methoxyphenyl)acrylonitrile
1-(1-ETHYL-2-METHYL-1H-BENZO[D]IMIDAZOL-5-YL)ETHANONE
3-(TRIMETHYLSILYL)ETHYNYLBENZALDEHYDE
C12H14OSi (202.08138739999998)
2-(1-methylimidazol-2-yl)benzoic acid
C11H10N2O2 (202.07422400000002)
1-(2-METHYL-3-NITROPHENYL)-1H-PYRROLE
C11H10N2O2 (202.07422400000002)
3-(2-Methyl-1H-imidazol-1-yl)benzoic acid
C11H10N2O2 (202.07422400000002)
(3-Methoxy-1-naphthyl)boronic acid
C11H11BO3 (202.08012060000001)
4-amino-8-methylquinoline-3-carboxylic acid
C11H10N2O2 (202.07422400000002)
(2-Methoxy-1-Naphthyl)Boronic Acid
C11H11BO3 (202.08012060000001)
N-METHYL-N-[(5-METHYL-3-PHENYLISOXAZOL-4-YL)METHYL]AMINE
1-Methyl-5-phenyl-1H-pyrazole-3-carboxylic acid
C11H10N2O2 (202.07422400000002)
(4-Methoxy-1-Naphthyl)Boronic Acid
C11H11BO3 (202.08012060000001)
Ethyl 1,7-naphthyridine-3-carboxylate
C11H10N2O2 (202.07422400000002)
N-(4-AMINO-2-METHYLPHENYL)-2-METHYLPROPANAMIDE
C11H10N2O2 (202.07422400000002)
5-phenylmethoxy-3H-pyrimidin-4-one
C11H10N2O2 (202.07422400000002)
3-Pyridinamine,6-butoxy-, hydrochloride (1:1)
C9H15ClN2O (202.08728499999998)
5,6-Dihydroimidazo[4,5,1-jk][1]benzazepine-2,7(1H,4H)-dione
C11H10N2O2 (202.07422400000002)
4-[(1-Imidazolyl)methyl]phenylboronic acid
C10H11BN2O2 (202.09135360000002)
β-D-Galactopyranose,1,6-anhydro-3,4-O-(1-methylethylidene)-
Benzaldehyde, 4-(1H-imidazol-1-yl)-3-methoxy-
C11H10N2O2 (202.07422400000002)
2-(3-Chloroprop-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
3-methoxy-4-pyrazol-1-ylbenzaldehyde
C11H10N2O2 (202.07422400000002)
5-ISOPROPYL-4-OXO-3,4-DIHYDROPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBONITRILE
5-HYDRAZINO-NAPHTHALENE-1-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
1-Methyl-3-phenyl-1H-pyrazole-5-carboxylic acid
C11H10N2O2 (202.07422400000002)
(3aR,5S,6S,6aR)-6-methoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-5-carbaldehyde
5-(2-methoxyphenyl)-1H-pyrazin-2-one
C11H10N2O2 (202.07422400000002)
5-(3-METHOXY-PHENYL)-1H-PYRAZIN-2-ONE
C11H10N2O2 (202.07422400000002)
2-[(TRIMETHYLSILYL)ETHYNYL]BENZALDEHYDE
C12H14OSi (202.08138739999998)
N1-(4-METHOXYPHENYL)-1,2-ETHANEDIAMINE
C9H15ClN2O (202.08728499999998)
5-METHYL-1-PHENYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
3-AMINO-N-(3,5-DIMETHYLPHENYL)BENZAMIDE
C11H10N2O2 (202.07422400000002)
3-Chloropropenyl-1-boronic acid pinacol ester,2-(3-Chloro-propenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
5-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid
C11H10N2O2 (202.07422400000002)
5-methyl-2-phenyl-1H-imidazole-4-carboxylic acid
C11H10N2O2 (202.07422400000002)
1-Phenyl-6-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
C11H10N2O2 (202.07422400000002)
2-(1-Methyl-1H-indol-3-yl)-2-oxoacetamide
C11H10N2O2 (202.07422400000002)
2-(2-methylphenoxy)ethylhydrazine,hydrochloride
C9H15ClN2O (202.08728499999998)
5-(4-METHOXY-PHENYL)-1H-PYRAZIN-2-ONE
C11H10N2O2 (202.07422400000002)
FURAN-2-CARBOXYLIC ACID (4-AMINO-PHENYL)-AMIDE
C11H10N2O2 (202.07422400000002)
5-AMINO-2-CYCLOPROPYL-1H-ISOINDOLE-1,3(2H)-DIONE
C11H10N2O2 (202.07422400000002)
5-methyl-2-phenyl-1,3-oxazole-4-carboxamide
C11H10N2O2 (202.07422400000002)
3-(4-METHYLPHENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
Ethyl 2-Cyano-3-(3-pyridyl)acrylate
C11H10N2O2 (202.07422400000002)
N-[(3-methyl-1,2-oxazol-5-yl)methyl]-1-phenylmethanamine
4-(4-Methyl-4H-1,2,4-triazol-3-yl)piperidine hydrochloride
C8H15ClN4 (202.09851799999998)
5-AMINO-1-(3-FLUOROPHENYL)-1H-PYRAZOLE-4-CARBONITRILE
1-Benzyl-1H-pyrazole-4-boronic acid
C10H11BN2O2 (202.09135360000002)
3-Quinolinecarboxylicacid,4-amino-6-methyl-(9CI)
C11H10N2O2 (202.07422400000002)
(2-PHENYL-1H-INDOL-1-YL)ACETICACID
C11H10N2O2 (202.07422400000002)
1H-Imidazole-4-carboxylicacid,2-methyl-5-phenyl-(9CI)
C11H10N2O2 (202.07422400000002)
2-(3,4-Dimethylphenyl)-1,2-dihydro-5-methyl-3H-pyrazol-3-one
methyl 5-phenyl-1H-pyrazole-4-carboxylate
C11H10N2O2 (202.07422400000002)
2,3,4,5-TETRAHYDRO-8-METHOXY-1H-PYRIDO[4,3-B]INDOLE
cyclopent[b]indole, 1,2,3,4-tetrahydro-7-nitro
C11H10N2O2 (202.07422400000002)
(2-[cyclohex-3-enyl]ethyl)dimethyl chlorosilane
C10H19ClSi (202.09444839999998)
1-hydroxynaphthalene-2-carbohydrazide
C11H10N2O2 (202.07422400000002)
N-METHYL-(4-METHYL-2-PHENYL-1,3-OXAZOL-5-YLMETHYL)AMINE
1H-1,3-Diazepine-4-carboxylicacid,hexahydro-2-(nitroimino)-,(+)-(8CI)
1-Naphthalenecarboxylicacid, 2-hydroxy-, hydrazide
C11H10N2O2 (202.07422400000002)
3-(4-methoxyphenyl)-1H-pyrazole-4-carbaldehyde
C11H10N2O2 (202.07422400000002)
2-(3-FORMYL-1H-INDOL-1-YL)ACETAMIDE
C11H10N2O2 (202.07422400000002)
4-(4-Aminophenoxy)pyridin-2(1H)-one
C11H10N2O2 (202.07422400000002)
7-Trifluoromethyl-1,2,3,4-tetrahydro-[2,6]naphthyridine
Methyl 4-(1H-pyrazol-5-yl)benzoate
C11H10N2O2 (202.07422400000002)
4-(4-Methoxyphenyl)-2(1H)-pyrimidinone
C11H10N2O2 (202.07422400000002)
Methyl 5-phenyl-1H-imidazole-2-carboxylate
C11H10N2O2 (202.07422400000002)
2-methyl-5-oxo-1-phenylpyrazole-3-carbaldehyde
C11H10N2O2 (202.07422400000002)
methyl (E)-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-enoate
C11H10N2O2 (202.07422400000002)
1-Benzyl-1H-pyrazole-4-carboxylic acid
C11H10N2O2 (202.07422400000002)
1-(6-Aminospiro[cyclopropane-1,3-indolin]-1-yl)ethanone
4-(Dimethylphenylsilyl)-3-butyn-2-one
C12H14OSi (202.08138739999998)
4-(1-Methyl-1H-pyrazol-3-yl)benzoic acid
C11H10N2O2 (202.07422400000002)
4-(1H-PYRAZOL-1-YLMETHYL)BENZOIC ACID
C11H10N2O2 (202.07422400000002)
N-Methyl-5-phenylisoxazole-3-carboxamide
C11H10N2O2 (202.07422400000002)
3,4-Dihydro-2H-1-oxa-4a,9-diaza-anthracen-10-one
C11H10N2O2 (202.07422400000002)
2-(2-methylimidazol-1-yl)benzoic acid
C11H10N2O2 (202.07422400000002)
1H-Benz[g]indazole-7,8-diol,4,5-dihydro-
C11H10N2O2 (202.07422400000002)
2-Naphthalenecarboxylicacid,3-hydrazino-(9CI)
C11H10N2O2 (202.07422400000002)
5-AMINO-1-(2-FLUOROPHENYL)-1H-PYRAZOLE-4-CARBONITRILE
Spiro[imidazolidine-4,2-[2H]indene]-2,5-dione,1,3-dihydro-
C11H10N2O2 (202.07422400000002)
2,3-DIMETHYL-QUINOXALINE-5-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
tolimidone
C11H10N2O2 (202.07422400000002)
C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent
4-[3-(DIMETHYLAMINO)PROP-1-YNYL]BENZALDEHYDE OXIME
Pyrrolo[4,3,2-de]quinoline-7,8-dione, 1,3,4,5-tetrahydro-5-methyl- (9CI)
C11H10N2O2 (202.07422400000002)
3-METHYL-1-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
Methyl 4-(1H-imidazol-1-yl)benzoate
C11H10N2O2 (202.07422400000002)
1,4-dihydroxy-3,3,6,6-tetramethylpiperazine-2,5-dione
5-PHENYL-1H-PYRAZOLE-3-CARBOXYLIC ACID METHYL ESTER
C11H10N2O2 (202.07422400000002)
Piperazine phosphate
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
3-(1-Methyl-1H-pyrazol-5-yl)benzoic acid
C11H10N2O2 (202.07422400000002)
Pyrrolo[4,3,2-de]quinoline-7,8-dione, 1,3,4,5-tetrahydro-1-methyl- (9CI)
C11H10N2O2 (202.07422400000002)
2-nitro-5,6,7,8-tetrahydronaphthalene-1-carbonitrile
C11H10N2O2 (202.07422400000002)
(1-(P-TOLYL)-1H-PYRAZOL-4-YL)BORONIC ACID
C10H11BN2O2 (202.09135360000002)
1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 2-cyclopropyl-
C11H10N2O2 (202.07422400000002)
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 3-ethenyl-, Methyl ester
C11H10N2O2 (202.07422400000002)
1-Allyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
C11H10N2O2 (202.07422400000002)
1-[(ACETYLTHIO)METHYL]-CYCLOPROPANEACETIC ACID METHYL ESTER
1-methyl-5-phenylpyrazole-4-carboxylic acid
C11H10N2O2 (202.07422400000002)
1-BENZYL-2-IMIDAZOLECARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
2-(4-(1H-PYRAZOL-1-YL)PHENYL)ACETIC ACID
C11H10N2O2 (202.07422400000002)
1-METHYL-4-PHENYL-1H-IMIDAZOLE-5-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
1-(2-methoxyphenyl)-1H-pyrazole-4-carbaldehyde
C11H10N2O2 (202.07422400000002)
1H-Pyrido[4,3-b]indol-4-ol, 2,3,4,5-tetrahydro-2-methyl-
3-AZIDO-2-OXO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE
1-(3-methoxyphenyl)-1H-pyrazole-4-carbaldehyde
C11H10N2O2 (202.07422400000002)
1-(4-Methylphenyl)-1H-pyrazole-3-carboxylic acid
C11H10N2O2 (202.07422400000002)
3-[3-(DIMETHYLAMINO)PROP-1-YNYL]BENZALDEHYDE OXIME
4-(2-Oxazolyl)-phenyl-N-Methylnitrone
C11H10N2O2 (202.07422400000002)
N-METHYL-N-[(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)METHYL]AMINE
1,6-ANHYDRO-2,3-O-ISOPROPYLIDENE-β-D-MANNOPYRANOSE
1,2,3,6,7,11SS-HEXAHYDRO-4H-PYRAZINO[2,1-A]ISOQUINOLINE-4-ONE
Carbamicacid,(3-oxo-4-isoxazolidinyl)-,1,1-dimethyl ethyl ester,(S)-(9CI)
4-(Trimethysilyl)-ethynylbenzaldehyde
C12H14OSi (202.08138739999998)
1-(4-methoxyphenyl)pyrazole-4-carbaldehyde
C11H10N2O2 (202.07422400000002)
1-(4-Methyl-2-nitrophenyl)-1H-pyrrole
C11H10N2O2 (202.07422400000002)
3-(1-methylpyrazol-3-yl)benzoic acid
C11H10N2O2 (202.07422400000002)
4-(1,3-BENZODIOXOL-5-YL)-3-METHYL-1H-PYRAZOLE
C11H10N2O2 (202.07422400000002)
Benzenamine, 3-fluoro-5-(4-methyl-3-pyridinyl)- (9CI)
3-(3-oxo-1,4-benzoxazin-4-yl)propanenitrile
C11H10N2O2 (202.07422400000002)
5-(2-methylphenyl)-1H-pyrimidine-2,4-dione
C11H10N2O2 (202.07422400000002)
3-(1H-PYRAZOL-1-YLMETHYL)BENZOIC ACID
C11H10N2O2 (202.07422400000002)
(E)-2-methyl-3-(2-nitrovinyl)-1H-indole
C11H10N2O2 (202.07422400000002)
3-(1-Methyl-5-imidazolyl)benzoic Acid
C11H10N2O2 (202.07422400000002)
3-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
[2-(2-methoxy-phenyl)-ethyl]-hydrazine hydrochloride
C9H15ClN2O (202.08728499999998)
(6-Methoxy-2-naphthyl)boronic acid
C11H11BO3 (202.08012060000001)
2,4-diisocyanato-1,3,5-trimethylbenzene
C11H10N2O2 (202.07422400000002)
2-AMINO-2-(QUINOLIN-6-YL)ACETIC ACID
C11H10N2O2 (202.07422400000002)
Methyl 3-(1H-imidazol-1-yl)benzoate
C11H10N2O2 (202.07422400000002)
1-(O-TOLYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
C11H10N2O2 (202.07422400000002)
1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)ethanone
1-(4-methoxyphenethyl)hydrazine hydrochloride
C9H15ClN2O (202.08728499999998)
Amezinium
C11H12N3O+ (202.09803219999998)
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors
4,4-Dimethyl-3-[(trimethylsilyl)oxy]dihydro-2(3H)-furanone
(5R, 6S, 7S, 8S)-5-Hydroxymethyl-6,7,8-trihydroxy-tetrazolo[1,5-A]piperidine
Idryl
D004791 - Enzyme Inhibitors
Pyren
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes
(2S,3R)-5-azaniumyl-3-hydroxy-2-(2-oxoazetidin-1-yl)pentanoate
(2S)-2-amino-3-[(3Z)-indol-3-ylidene]propanoate
C11H10N2O2 (202.07422400000002)
(E)-2-amino-3-(1H-indol-3-yl)prop-2-enoic acid
C11H10N2O2 (202.07422400000002)
(2S)-2-[(4S)-4-amino-4-carboxybutyl]aziridine-2-carboxylic acid
(2S,3Z)-2-amino-3-indol-3-ylidenepropanoic acid
C11H10N2O2 (202.07422400000002)
(2E)-1-methyl-2-nitro-3-(tetrahydrofuran-3-ylmethyl)guanidine
(2Z)-2-[[hydroxy(methyl)amino]methylidene]quinolin-8-one
C11H10N2O2 (202.07422400000002)
10-Amino-7-methyl-2-aza-7-azoniatricyclo[6.3.1.04,12]dodeca-1(11),2,4(12),7,9-pentaen-11-ol
C11H12N3O+ (202.09803219999998)
4-methyl-2-phenyl-1H-pyridazine-3,6-dione
C11H10N2O2 (202.07422400000002)
7-Amino-1-methyl-8-oxo-3,4,5,8-tetrahydropyrrolo[4,3,2-de]quinolin-1-ium
C11H12N3O+ (202.09803219999998)
1-(2-amino-3-hydroxypropanoyl)pyrrolidine-2-carboxylic acid
1,1a,7,7a-Tetrahydro-1a,7a-dimethyl-7-methylenebenzo[b]cyclopropa[e]thiopyran
ethyl ethoxalylpropionate
Diethyl oxalpropionate is an intermediate for poly((R,S)-3,3-dimethylmalic acid) (PDMMLA) derivative synthesis. PDMMLA derivative can be used in synthesis of nanoparticles and study of warfarin encapsulation and controlled release[1].
Scorpion
Dinotefuran is an insecticide of the neonicotinoid class, its mechanism of action involves disruption of the insect's nervous system by inhibiting nicotinic acetylcholine receptors. Target: nAChR, Antiparasitic
alpha,beta-Didehydrotryptophan
C11H10N2O2 (202.07422400000002)
A dehydroamino acid that is the 2,3-didehydro derivative of tryptophan.
PYRENE
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes
2-imino-3-(indol-3-yl)propanoic acid
C11H10N2O2 (202.07422400000002)
A dehydroamino acid that is tryptophan in which the amino group has been oxidised to the corresponding imine.
alpha,beta-didehydrotryptophan zwitterion
C11H10N2O2 (202.07422400000002)
An amino acid zwitterion resulting from a transfer of a proton from the carboxy group to the amino group of alpha,beta-didehydrotryptophan; major species at pH 7.3.
Indole-3-butyrate
An indol-3-yl carboxylic acid anion that is the conjugate base of indole-3-butyric acid, arising from the deprotonation of the carboxy group.
Coprine
A non-proteinogenic L-alpha-amino acid that is L-glutamine in which one of the hydrogens attached to the amide nitrogen is replaced by a 1-hydroxycyclopropyl group. Found in the ink-cap mushroom, Coprinus atramentarius, it causes an unpleasant hypersensitivity to alcohol (the disulfiram effect).
2-iminio-3-(indol-3-yl)propanoate
C11H10N2O2 (202.07422400000002)
Zwitterionic imine tautomer of alpha,beta-didehydrotryptophan.
proclavaminic acid zwitterion
Zwitterionic form of proclavaminic acid.
ABT-418 (hydrochloride)
C9H15ClN2O (202.08728499999998)
ABT-418 hydrochloride is a potent and selective agonist of nAChRs with cognitive enhancing and anxiolytic activities. ABT-418 hydrochloride activates cholinergic channel and can be used for research of Alzheimer's disease[1][2].
(2s)-2-amino-4-[(1-hydroxycyclopropyl)-c-hydroxycarbonimidoyl]butanoic acid
7-amino-1,6-dimethylisoquinoline-5,8-dione
C11H10N2O2 (202.07422400000002)
1-(5-ethenyl-2-hydroxyphenyl)-3-methylbut-2-en-1-one
2-(2-thienylidene)-1,6-dioxaspiro[4.5]dec-3-ene
{"Ingredient_id": "HBIN003785","Ingredient_name": "2-(2-thienylidene)-1,6-dioxaspiro[4.5]dec-3-ene","Alias": "NA","Ingredient_formula": "C13H14O2","Ingredient_Smile": "NA","Ingredient_weight": "234.318","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9077","PubChem_id": "NA","DrugBank_id": "NA"}
6-amino-2,3-dimethylquinoline-5,8-dione
C11H10N2O2 (202.07422400000002)
(5s)-5-methyl-3-(6-methylhepta-1,5-dien-3-yn-2-yl)-5h-furan-2-one
(3r)-3-hydroxy-1h,2h,3h-pyrrolo[2,1-b]quinazolin-9-one
C11H10N2O2 (202.07422400000002)
4a,5,7-trihydroxy-7-methyl-tetrahydro-1h-cyclopenta[c]pyran-3-one
[(1r,4r,5s)-4,5-dihydroxy-2-(hydroxymethyl)-3-methylcyclopent-2-en-1-yl]acetic acid
(4r,5r)-4-hydroxy-5-(2-hydroxyethyl)-2-(hydroxymethyl)cyclopent-1-ene-1-carboxylic acid
(1r,4s,5r,6s,7r,11s)-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol
(5r)-3-[(1s,2r)-1,2-dihydroxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one
2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol
1-[4-hydroxy-3-(3-methylbuta-1,3-dien-1-yl)phenyl]ethanone
(4as,5r,7s,7ar)-4a,5,7-trihydroxy-7-methyl-tetrahydro-1h-cyclopenta[c]pyran-3-one
(2s,3as,6r,6ar)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-tetrahydrofuro[2,3-c]furan-4-one
5-methyl-3-(6-methylhepta-1,5-dien-3-yn-2-yl)-5h-furan-2-one
6-hydroxy-3-(prop-1-en-2-yl)-3,4-dihydro-2h-naphthalen-1-one
2-methyl-3-[(1e)-2-nitroethenyl]-1h-indole
C11H10N2O2 (202.07422400000002)
(5r)-5-hydroxy-4-methoxy-5-[(2r)-1-methoxypropan-2-yl]furan-2-one
2-methyl-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),3,8-triene-10,11-dione
C11H10N2O2 (202.07422400000002)
(1r,4s,5s,6s,7r,11s)-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undecane-4,5,6-triol
4-hydroxy-5-(2-hydroxyethyl)-2-(hydroxymethyl)cyclopent-1-ene-1-carboxylic acid
4-hydroxy-5-(1-hydroxyethyl)-3-(2-hydroxypropylidene)oxolan-2-one
(5r)-3-methyl-5-[(1s,2r,3r)-1,2,3-trihydroxybutyl]-5h-furan-2-one
(2r,3as,6r,6ar)-2-hydroxy-2-(1-hydroxyethyl)-6-methyl-tetrahydrofuro[2,3-c]furan-4-one
1-[(2s)-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran-5-yl]ethanone
6-methyl-2-(prop-1-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
(3s,4s,5e,11e)-trideca-1,5,11-trien-7,9-diyne-3,4-diol
5-hydroxy-1h,2h,3h-pyrrolo[2,1-b]quinazolin-9-one
C11H10N2O2 (202.07422400000002)
(3s)-6-hydroxy-3-(prop-1-en-2-yl)-3,4-dihydro-2h-naphthalen-1-one
methyl 1-methyl-2,7-naphthyridine-4-carboxylate
C11H10N2O2 (202.07422400000002)
(2s,4s,5s,10r)-2-(hydroxymethyl)-3,9-dioxatricyclo[4.4.0.0²,⁴]decane-5,10-diol
(5r)-3-[(1r,2s)-1,2-dihydroxypropyl]-5-[(1s)-1-hydroxyethyl]-5h-furan-2-one
3-(1,2-dihydroxypropyl)-5-(1-hydroxyethyl)-5h-furan-2-one
(4r,5r)-4-hydroxy-5-[(1r)-1-hydroxyethyl]-3-[(2s)-2-hydroxypropylidene]oxolan-2-one
[4-methoxy-3-(3-methylbut-3-en-1-yn-1-yl)phenyl]methanol
(4s,5r)-3-[(2r,3s)-2,3-dihydroxybutylidene]-4-hydroxy-5-methyloxolan-2-one
7-methyl-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),3,8-triene-10,11-dione
C11H10N2O2 (202.07422400000002)
1-{4-hydroxy-3-[(1e)-3-methylbuta-1,3-dien-1-yl]phenyl}ethanone
6-hydroxy-2h,3h,4h,9h-pyrido[3,4-b]indol-1-one
C11H10N2O2 (202.07422400000002)