Exact Mass: 224.0532152
Exact Mass Matches: 224.0532152
Found 500 metabolites which its exact mass value is equals to given mass value 224.0532152,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Sinapic acid
Sinapic acid, also known as sinapinate, belongs to the class of organic compounds known as hydroxycinnamic acids. Hydroxycinnamic acids are compounds containing an cinnamic acid where the benzene ring is hydroxylated. Sinapic acid has been detected, but not quantified, in several different foods, such as strawberry guava, purple lavers, common verbena, ryes, and lupines. This could make sinapic acid a potential biomarker for the consumption of these foods. A sinapic acid in which the double bond has trans-configuration. Trans-sinapic acid is a sinapic acid in which the double bond has trans-configuration. It has a role as a MALDI matrix material and a plant metabolite. It is a conjugate acid of a trans-sinapate. Sinapic acid is a matrix for matrix-assisted laser desorption technique for protein MW determination. It is also a constituent of propolis. Sinapic acid is a natural product found in Sida acuta, Limoniastrum guyonianum, and other organisms with data available. A common constituent of plants and fruits. trans-Sinapic acid is found in many foods, some of which are small-leaf linden, redcurrant, malabar spinach, and blackcurrant. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents A sinapic acid in which the double bond has trans-configuration. Acquisition and generation of the data is financially supported in part by CREST/JST. Profile spectrum of this record is given as a JPEG file.; [Profile] MCH00014.jpg Profile spectrum of this record is given as a JPEG file.; [Profile] MCH00015.jpg CONFIDENCE standard compound; INTERNAL_ID 174 Annotation level-1 Annotation level-2 KEIO_ID S028 Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3]. Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3].
1-Hydroxyanthraquinone
CONFIDENCE standard compound; INTERNAL_ID 8284 CONFIDENCE standard compound; INTERNAL_ID 25 D009676 - Noxae > D002273 - Carcinogens 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1]. 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1].
Gesfid
D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals
phenazine-1-carboxylic acid
An aromatic carboxylic acid that is phenazine substituted at C-1 with a carboxy group. CONFIDENCE standard compound; INTERNAL_ID 190 Phenazine-1-carboxylic acid exhibits strong antifungal activity against phytopathogenic fungi.
NIFURADENE
C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent
Sideretin (reduced form)
A hydroxycoumarin that is fraxetin which has been substituted by an additional hydroxy group at positions 5. It is the primary molecule exuded by Arabidopsis thaliana roots in response to iron deficiency.
Hydroxyanthraquinone
1-hydroxyanthraquinone is a monohydroxyanthraquinone. 1-Hydroxyanthraquinone is a natural product found in Rheum palmatum, Handroanthus impetiginosus, and Morinda citrifolia with data available. D009676 - Noxae > D002273 - Carcinogens 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1]. 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1].
Elenolide
Constituent of olive oil. Elenolide is found in many foods, some of which are fats and oils, olive, pomes, and herbs and spices. Elenolide is found in fats and oils. Elenolide is a constituent of olive oil
Dehydrochorismic acid
Dehydrochorismic acid is isolated from pollen of Pinus densiflora (Japanese red pine Isolated from pollen of Pinus densiflora (Japanese red pine)
Cysteinyl-Cysteine
C6H12N2O3S2 (224.02893219999999)
Cysteinyl-Cysteine is a dipeptied compoosed of two cysteine residues. 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.
Propyl 1-(propylthio)propyl disulfide
Propyl 1-(propylthio)propyl disulfide is found in onion-family vegetables. Propyl 1-(propylthio)propyl disulfide is a constituent of Allium cepa (onion) and Allium fistulosum (Welsh onion). Constituent of Allium cepa (onion) and Allium fistulosum (Welsh onion). Propyl 1-(propylthio)propyl disulfide is found in garden onion and onion-family vegetables.
cis-Sinapic acid
cis-Sinapic acid is found in pulses. cis-Sinapic acid is a constituent of shoots of Medicago sativa (alfalfa). Constituent of shoots of Medicago sativa (alfalfa). cis-Sinapic acid is found in pulses and common pea. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents
5-(3',4',5'-Trihydroxyphenyl)-gamma-valerolactone
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
7-Methyl-6,8-bis(methylthio)pyrrolo(1,2-a)pyrazine
C10H12N2S2 (224.04418719999998)
(3As)-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide
Trinexapac
A monocarboxylic acid that is 3,5-dioxocyclohexanecarboxylic acid substituted by a cyclopropyl(hydroxy)methylidene group at position 4. It is a metabolite of the plant growth regulator trinexapac-ethyl. CONFIDENCE standard compound; EAWAG_UCHEM_ID 150
4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydro-1h-isochromen-1-one
2-(Methylsulfonyl)-3-(pyrazin-2-ylamino)acrylonitrile
2-Hydroxyanthraquinone
CONFIDENCE standard compound; INTERNAL_ID 24 CONFIDENCE standard compound; INTERNAL_ID 8289 CONFIDENCE standard compound; INTERNAL_ID 8144 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1]. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1].
1-(3-acetyl-2,4-dihydroxy-6-methoxyphenyl)ethan-1-one
(E)-2-hydroxyethyl 3-(3,4-dihydroxyphenyl)acrylate|2-hydroxyethyl caffeate|hydroxyethyl caffeate
1-Methoxy-5,7-Dihydroxy-4,6-dimethyl-1(3H)-isobenzofuranone|5,7-Dihydroxy-4-(methoxymethyl)-6-methyl-1(3H)-isobenzofuranon
2,4-diformyl-3,5-dihydroxybenzoic acid methyl ester|rubramin
3-Methyl-4-(2,3-dihydroxyphenyl)-4-oxo-butanoic acid
3-Acetyl-2,6-dihydroxy-4-methoxy-5-methyl-benzaldehyd|3-Acetyl-2,6-dihydroxy-4-methoxy-5-methylbenzaldehyde|3-formyl-2,4-dihydroxy-5-methyl-6-methoxy-acetophenone|Kosin 16
3-(4-methoxy-3,5-dimethyl-2-oxo-2h-pyran-6-yl)-2-propenoic acid
(3S,4S)-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone|3,4,8-trihydroxy-6-methoxy-3,4-dihydro-1(2H)-naphthalenone
3,4,8-trihydroxy-6-(hydroxymethyl)-3,4-dihydronaphthalen-1(2H)-one
3-methoxy-6,8-dihydroxy-3-methyl-3,4-dihydroisocoumarin
1-[rel-(2S,3S)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]ethanone
4-(1-Hydroxyethyl)-6,8-dihydroxy-3,4-dihydro-1H-2-benzopyran-1-one
3-acetyl-2,4-dihydroxy-6-methoxy-5-methylbenzaldehyde
(+)-pestaphthalide A|5,7-dihydroxy-3-(1-hydroxyethyl)-6-methyl-3H-isobenzofuran-1-one|pestaphthalide A
3-Hydroxy-4-hydroxymethyl-7-methoxy-6-methyl-phthalid|3-hydroxy-4-hydroxymethyl-7-methoxy-6-methyl-phthalide
Methyl 6-methoxy-2-methyl-3,4-methylene dioxybenzoate
3R-5-formyl-4,6-dihydroxy-3-methoxyphthalide|rubralide A
6-Me ether-3,5,6-Trihydroxy-3-menthyl-1H-2-benzopyran-4-one
(3Z,5E)-octa-3,5-diene-1,3,4-tricarboxylic acid 3,4-anhydride|(3Z,5E)-Octa-3,5-diene-1,3,4-tricarboxylic acid anhydride
1-(4-hydroxy-3,5-dimethoxy-phenyl)-propane-1,2-dione
Vasicine HCl
Vasicine hydrochloride (peganine hydrochloride) is a quinazoline alkaloid isolated from Justicia adhatoda. Vasicine (peganine) possesses anti- tuberculosis activity[1]. Vasicine hydrochloride (peganine hydrochloride) is a quinazoline alkaloid isolated from Justicia adhatoda. Vasicine (peganine) possesses anti- tuberculosis activity[1].
Tox21_202901
2-hydroxyanthraquinone is a monohydroxyanthraquinone. 2-Hydroxyanthraquinone is a natural product found in Primulina hedyotidea, Rubia tinctorum, and Galium odoratum with data available. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1]. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1].
sinapic acid
Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3]. Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3].
2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid
4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydroisochromen-1-one
6,8-dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
4,8-dihydroxy-6-methoxy-3-methyl-3,4-dihydroisochromen-1-one
OCP_225.0789_16.6
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1304
mevinphos
D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals
tubermycin B
Origin: Microbe; SubCategory_DNP: Isoquinoline alkaloids, Benzylisoquinoline alkaloids Phenazine-1-carboxylic acid exhibits strong antifungal activity against phytopathogenic fungi.
2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid [IIN-based: Match]
2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid [IIN-based on: CCMSLIB00000845767]
2-(2-acetyl-3-hydroxy-5-methoxyphenyl)acetic acid_major
Sinapinic acid
Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3]. Sinapinic acid (Sinapic acid) is a phenolic compound isolated from Hydnophytum formicarum Jack. Rhizome, acts as an inhibitor of HDAC, with an IC50 of 2.27 mM[1], and also inhibits ACE-I activity[2]. Sinapinic acid posssess potent anti-tumor activity, induces apoptosis of tumor cells[1]. Sinapinic acid shows antioxidant and antidiabetic activities[2]. Sinapinic acid reduces total cholesterol, triglyceride, and HOMA-IR index, and also normalizes some serum parameters of antioxidative abilities and oxidative damage in ovariectomized rats[3].
Cys-cys
C6H12N2O3S2 (224.02893219999999)
A dipeptide formed from two L-cysteine residues.
cis-Sinapic acid
A 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid in which the double bond has cis-configuration. It has been isolated from the shoots of alfalfa. D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents
1-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]ethanamine
C8H8ClF3N2 (224.03280739999997)
Methyl 2-(chloromethyl)-1H-benzo[d]imidazole-7-carboxylate
6-Chloro-2,3-dihydro-1H-indene-1-carboxylic acid ethyl ester
C12H13ClO2 (224.06040280000002)
Ethyl 3-chloro-imidazo[1,5-a]pyridine-1-carboxylate
3-(2-HYDROXY-4-METHOXY-PHENYL)-3-OXO-PROPIONIC ACID METHYL ESTER
5-Chloro-1H-indazole-3-carboxylic acid ethyl ester
(4-Methoxybenzyl)hydrazine dihydrochloride
C8H14Cl2N2O (224.04831339999998)
3-METHOXYBENZYLHYDRAZINE DIHYDROCHLORIDE
C8H14Cl2N2O (224.04831339999998)
2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]acetic acid
C10H9FN2O3 (224.05971759999997)
1-(4-Chlorophenyl)cyclopentanecarboxylic acid
C12H13ClO2 (224.06040280000002)
2-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)ethanamine
C8H8ClF3N2 (224.03280739999997)
Benzoic acid,4-[(aminothioxomethyl)amino]-, ethyl ester
1-(4-CHLOROPHENYL)-5-PROPYL-1H-PYRAZOLE-4-CARBONYLCHLORIDE
C12H13ClO2 (224.06040280000002)
3-(Trifluoromethyl)benzene-1-carboximidamide hydrochloride
C8H8ClF3N2 (224.03280739999997)
2-CHLOROMETHYL-IMIDAZO[1,2-A]PYRIDINE-8-CARBOXYLIC ACID METHYL ESTER
Ethyl 6-chloroimidazo[1,2-a]pyridine-2-carboxylate
ethyl 5-chloro-1H-pyrrolo(2,3-c)pyridine-2-carboxylate
(4,6-DIMETHYL-2,5-DIOXO-HEXAHYDRO-IMIDAZO-[4,5-D]IMIDAZOL-1-YL)-ACETICACID
methyl 4-chloropyrazolo[1,5-a]pyridine-3-carboxylate
N-Methyl-3-phenyl-5-isoxazolemethanamine hydrochloride
3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-THIOCHROMEN-4-ONE
3-(Chloromethyl)-5-(2-methoxyphenyl)-1,2,4-oxadiazole
2-(chloromethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
5-Chloro-3-((trimethylsilyl)ethynyl)pyridin-2-amine
C10H13ClN2Si (224.05364880000002)
2-Chloro-3-((trimethylsilyl)ethynyl)pyridin-4-amine
C10H13ClN2Si (224.05364880000002)
4-Chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid ethyl ester
(4-CHLORO-2-METHYLPHENOXY)ACETICACIDMETHYLESTER
C8H8ClF3N2 (224.03280739999997)
4-HYDROXY-5-METHYL-ISOPHTHALIC ACID DIMETHYL ESTER
5-(chloromethyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole
5,7-Dimethyl-2,3-dihydro-1H-[1,4]diazepine perchlorate
1-CHLORO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZENE
C11H14BClO2 (224.07753240000002)
2-Propen-1-one,3,3-bis(methylthio)-1-phenyl-
C11H12OS2 (224.03295419999998)
1H-Pyrazolo[4,3-d]pyrimidine-3-carboxylic acid, 4,5,6,7-tetrahydro-5,7-dioxo-, ethyl ester
3-(METHYLCARBAMOYL)-5-NITROPHENYLBORONIC ACID
C8H9BN2O5 (224.06044939999998)
4-(2-Chloro-acetyl)-3,4-dihydro-1H-quinoxalin-2-one
ethyl 5-chloroimidazo[1,5-a]pyridine-1-carboxylate
5-CHLORO-1H-BENZOIMIDAZOLE-2-CARBOXYLIC ACID ETHYL ESTER
4-(3-FLUORO-4-METHOXYPHENYL)THIAZOL-2-YLAMINE
C10H9FN2OS (224.04195959999996)
(4-((CYCLOPROPYLMETHYL)SULFINYL)PHENYL)BORONIC ACID
C10H13BO3S (224.06784180000002)
1-(3-CHLOROPHENYL)CYCLOPENTANECARBOXYLIC ACID
C12H13ClO2 (224.06040280000002)
3a-(Difluoromethyl)-2,3,3a,4-tetrahydro-1H-benzo[d]pyrrolo[1,2-a]imidazol-1-one
3-Acetao-2-nitrophenylboronic acid
C8H9BN2O5 (224.06044939999998)
5-Acetamido-2-nitrophenylboronic acid
C8H9BN2O5 (224.06044939999998)
N-METHYL-1-(5-PHENYLISOXAZOL-3-YL)METHANAMINE HYDROCHLORIDE
(E)-3-(Methoxycarbonyl)-4-(5-methylfuran-2-yl)but-3-enoic acid
ETHYL 2-AMINO-4-(TRIFLUOROMETHYL)OXAZOLE-5-CARBOXYLATE
2,2,2-Trifluoro-N-(2-oxa-6-azaspiro[3.4]oct-8-yl)acetamide
2-(PROPYLTHIO)BENZO[D]THIAZOL-6-AMINE
C10H12N2S2 (224.04418719999998)
3,6-DIMETHYLIMIDAZO[2,1-B]THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
(S)-6-METHOXY-2,5,7,8-TETRAMETHYLCHROMANE-2-CARBOXYLICACID
3-amino-4-methoxybenzene-methanamine dihydrochloride
C8H14Cl2N2O (224.04831339999998)
5-(AMINOMETHYL)-2-METHOXYANILINE DIHYDROCHLORIDE
C8H14Cl2N2O (224.04831339999998)
3-(AMINOMETHYL)-4-METHOXYANILINE DIHYDROCHLORIDE
C8H14Cl2N2O (224.04831339999998)
5-(Chloromethyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole
(6-Chloro-4-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)acetic acid
ethyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
Ethyl 6-chloropyrazolo[1,5-a]pyridine-3-carboxylate
1,3-Benzenedicarboxylic acid, 5-(hydroxyMethyl)-, 1,3-dimethyl ester
IMidazo[1,2-a]pyridine-2-carboxylic acid, 7-chloro-, ethyl ester
dimethyl 5-hydroxy-3-methylbenzene-1,2-dicarboxylate
4-chloro-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide
1-(4-Chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)-2-methoxyethanone
4-(1,1,2,2-tetrafluoroethoxy)-3-benzenediamine
C8H8F4N2O (224.05727259999998)
ethyl 4-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxylate
3-(chloromethyl)-5-(4-methoxyphenyl)-1,2,4-oxadiazole
Pyrimidine, 4-ethyl-2-(methylsulfonyl)-6-(1-propynyl)- (9CI)
propan-2-yl 5-amino-4-cyano-3-methylthiophene-2-carboxylate
2-Methoxybenzylhydrazine dihydrochloride
C8H14Cl2N2O (224.04831339999998)
ethyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
Ethyl 5-chloro-1H-pyrrolo[3,2-b]pyridine-2-carboxylate
2-(3-methoxy-4-(methoxycarbonyl)phenyl)acetic acid
4-Methoxybenzylhydrazine dihydrochloride
C8H14Cl2N2O (224.04831339999998)
1-(Methoxymethyl)-3-(trifluoromethyl)-1H-pyrazol-4-ylboronic acid
Methyl 2-(4-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)acetate
2,3-DIHYDRO-6,7-DIMETHOXY-4H-1-BENZOTHIOPYRAN-4-ONE
Ethyl 6-chloro-1H-pyrrolo[3,2-b]pyridine-5-carboxylate
2-Amino-8-chloro-1,2,3,4-tetrahydro-2-naphthalenecarboxamide
3-(chloromethyl)-5-(3-methoxyphenyl)-1,2,4-oxadiazole
6-Benzothiazolamine,2-[(1-methylethyl)thio]-(9CI)
C10H12N2S2 (224.04418719999998)
ethyl 5-chloroimidazo[1,2-a]pyridine-3-carboxylate
4-(2-chlorophenyl)oxane-4-carbaldehyde
C12H13ClO2 (224.06040280000002)
4-(3-Chlorophenyl)tetrahydropyran-4-carboxaldehyde
C12H13ClO2 (224.06040280000002)
3-Acetamido-4-nitrophenylboronic acid
C8H9BN2O5 (224.06044939999998)
Ethyl 5-chloroimidazo[1,2-a]pyridine-2-carboxylate
Ethyl 4-fluorobenzo[b]thiophene-2-carboxylate
C11H9FO2S (224.03072659999998)
3-(Carboxymethyl)-1,2,4-cyclopentanetricarboxylic Acid 1,4:2,3-Dianhydride
4-Amino-4-deoxychorismate(1-)
C10H10NO5- (224.05589500000002)
A dicarboxylic acid monoanion that is the conjugate base of 4-amino-4-deoxychorismic acid.
2,2,3,3-Tetrahydroxy-2,3-dihydronaphthalene-1,4-dione
N-(4,5-dihydro-1,3-thiazol-2-yl)-1-ethyl-1H-pyrazole-3-carboxamide
C9H12N4OS (224.07317819999997)
129-43-1
D009676 - Noxae > D002273 - Carcinogens 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1]. 1-Hydroxyanthraquinone, a naturally occurring compound with oral activity from some plants like Tabebuia avellanedae, exhibits carcinogenic effect[1].
605-32-3
2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1]. 2-Hydroxyanthraquinone, a natural compound, possesses antitumor and immunosuppressive activity[1].
(3As)-2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,2,4]benzothiadiazine 5,5-dioxide
3-(Carboxymethylaminomethyl)-4-hydroxybenzoate
C10H10NO5- (224.05589500000002)
(3S)-3-(1-carboxyethenoxy)cyclohepta-1,6-diene-1-carboxylic acid
(4R,5R,6S)-4,5,6,7,7-pentahydroxy-2-oxoheptanoic acid
1-(2-Furanyl)-2-[(1-methyl-5-tetrazolyl)thio]ethanone
3-(3-Hydroxy-4,5-dimethoxyphenyl)prop-2-enoic acid
3,4-dihydroxy-7-methylidene-2-[(E)-prop-1-enyl]-3,4-dihydro-2H-furo[3,4-b]pyran-5-one
N-(2-hydroxy,5-methoxyphenyl)malonamate
C10H10NO5- (224.05589500000002)
6,8-Dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
(1s,4s)-prephenate(2-)
A prephenate(2-) obtained by deprotonation of both carboxy groups of (1s,4s)-prephenic acid; major species at pH 7.3.
Prephenate(2-)
A dicarboxylic acid dianion that is the conjugate base of prephenic acid; major species at pH 7.3.
5-(3,4,5-Trihydroxyphenyl)-gamma-valerolactone
A butan-4-olide that is gamma-valerolactone in which one of the methyl hydrogens has been replaced by a 3,4,5-trihydroxyphenyl group.
S 18986
S 18986 is a selective, orally active, brain penetrant positive allosteric modulator of AMPA-type receptors. S 18986 shows cognitive enhancing properties in rodents. S 18986 activates the release of noradrenaline and acetylcholine in rat hippocampus and enhances rat memory in object-recognition tests[1][2].
(5e)-5-(1,5,6-trihydroxy-5-methylhex-3-yn-2-ylidene)furan-2-one
3-hydroxy-4-(hydroxymethyl)-7-methoxy-6-methyl-3h-2-benzofuran-1-one
2-{[(2e)-3-methanesulfinylprop-2-en-1-yl]disulfanyl}butane
(2s)-4-hydroxy-2,6-dimethoxy-5-methyl-2h-1-benzofuran-3-one
(4,6-dihydroxy-3-oxo-1h-2-benzofuran-1-yl)acetic acid
(1s,5r,7r,10r,11s)-10-hydroxy-11-methyl-4-methylidene-3,6-dioxatricyclo[5.3.1.0¹,⁵]undecane-2,9-dione
3,4,8-trihydroxy-6-methoxy-3,4-dihydro-2h-naphthalen-1-one
6,8-dihydroxy-3-(hydroxymethyl)-7-methyl-3,4-dihydro-2-benzopyran-1-one
(4s,5s,6r,10s)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
(2s)-2-{[(2e)-3-[(s)-methanesulfinyl]prop-2-en-1-yl]disulfanyl}butane
(5-hydroxy-2,4-dimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl acetate
(6r,10r)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
1-[(2r,3s)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl]ethanone
(3s)-3-[(1s,2s)-1,2-dihydroxypropyl]-6-hydroxy-3h-2-benzofuran-1-one
methyl 4-hydroxy-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undeca-5,8-diene-8-carboxylate
(2r,3r,4r,5r)-2,3,5-trihydroxy-4-methoxyhexanedioic acid
(3r,4s)-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-2h-naphthalen-1-one
(3s,4s)-3,4,8-trihydroxy-6-methoxy-3,4-dihydro-2h-naphthalen-1-one
3-hydroxy-6-methyl-4-oxo-6,7-dihydro-5h-1-benzofuran-5-yl acetate
(2e)-4-[(3z,4s,5r)-4-hydroxy-5-[(1e)-3-hydroxyprop-1-en-1-yl]-2-oxooxolan-3-ylidene]but-2-enal
4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
1- hydroxyl-7hydroxymethylanthraquinone
{"Ingredient_id": "HBIN002654","Ingredient_name": "1- hydroxyl-7hydroxymethylanthraquinone","Alias": "NA","Ingredient_formula": "C14H8O3","Ingredient_Smile": "C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37038","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,5-diformyl-2,4-dihydroxy-6-methylbenzoic acid
{"Ingredient_id": "HBIN007606","Ingredient_name": "3,5-diformyl-2,4-dihydroxy-6-methylbenzoic acid","Alias": "NA","Ingredient_formula": "C10H8O6","Ingredient_Smile": "NA","Ingredient_weight": "224.17","OB_score": "39.00228038","CAS_id": "60011-10-1","SymMap_id": "SMIT12685","TCMID_id": "NA","TCMSP_id": "MOL011837","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-aldehyde-6-methyl-2,4-dihydroxy-ethyl-benzoate
{"Ingredient_id": "HBIN007887","Ingredient_name": "3-aldehyde-6-methyl-2,4-dihydroxy-ethyl-benzoate","Alias": "NA","Ingredient_formula": "C11H12O5","Ingredient_Smile": "CCOC(=O)C1=C(C(=C(C=C1C)O)C=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "873","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-hydroxy-5-methoxy-3-(3-oxobutan-2-yl)cyclohexa-2,5-diene-1,4-dione
(3s)-3-hydroxy-4-(hydroxymethyl)-7-methoxy-6-methyl-3h-2-benzofuran-1-one
4-(4-methoxy-2-methyl-6-oxopyran-3-yl)but-2-enoic acid
(2e,4e,6e,8e,10e)-11-chlorododeca-2,4,6,8,10-pentaenoic acid
C12H13ClO2 (224.06040280000002)
(2e)-3-(4-methoxy-5-methyl-6-oxopyran-2-yl)but-2-enoic acid
3-(4-methoxy-5-methyl-6-oxopyran-2-yl)but-2-enoic acid
methyl (1s,4s,7s,11s)-4-hydroxy-2,10-dioxatricyclo[5.3.1.0⁴,¹¹]undeca-5,8-diene-8-carboxylate
6,8-dihydroxy-4-(1-hydroxyethyl)-3,4-dihydro-2-benzopyran-1-one
(3s)-6-hydroxy-3-(hydroxymethyl)-8-methoxy-3,4-dihydro-2-benzopyran-1-one
6-hydroxy-3-(hydroxymethyl)-8-methoxy-3,4-dihydro-2-benzopyran-1-one
(3r,4s)-4,8-dihydroxy-5-(hydroxymethyl)-3-methyl-3,4-dihydro-2-benzopyran-1-one
(2r)-2,5-dihydroxy-7-methoxy-2-methyl-3h-1-benzopyran-4-one
3,4,8-trihydroxy-6-(hydroxymethyl)-3,4-dihydro-2h-naphthalen-1-one
5,7-dihydroxy-8-methoxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
(4r,5r,6r,10r)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
(2-acetyl-3,5-dihydroxy-6-methylphenyl)acetic acid
3-[4-(but-1-en-1-yl)-2,5-dioxofuran-3-yl]propanoic acid
3-hydroxy-5,7-dimethoxy-3-methyl-2-benzofuran-1-one
(3r)-6,8-dihydroxy-3-(hydroxymethyl)-7-methyl-3,4-dihydro-2-benzopyran-1-one
3,5-dihydroxy-6-methoxy-3-methyl-1h-2-benzopyran-4-one
6-hydroxy-4,7-dimethoxy-5-methyl-3h-2-benzofuran-1-one
5-formyl-2-hydroxy-4-(methoxycarbonyl)benzoic acid
[(1s)-4,6-dihydroxy-3-oxo-1h-2-benzofuran-1-yl]acetic acid
5,7-dihydroxy-4-(methoxymethyl)-6-methyl-3h-2-benzofuran-1-one
(4s,5s,6s,10s)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
(2r)-2-{[(2e)-3-[(r)-methanesulfinyl]prop-2-en-1-yl]disulfanyl}butane
methyl (2e)-3-(3,4-dihydroxy-5-methoxyphenyl)prop-2-enoate
(2e)-4-(4-methoxy-2-methyl-6-oxopyran-3-yl)but-2-enoic acid
(3s)-5,7-dihydroxy-3-[(1s)-1-hydroxyethyl]-6-methyl-3h-2-benzofuran-1-one
(3s,4s)-3,4,8-trihydroxy-6-(hydroxymethyl)-3,4-dihydro-2h-naphthalen-1-one
4-(2,3-dihydroxyphenyl)-2-methyl-4-oxobutanoic acid
5-hydroxy-4-(hydroxymethyl)-7-methoxy-6-methyl-3h-2-benzofuran-1-one
(2s)-4-hydroxy-2,6-dimethoxy-7-methyl-2h-1-benzofuran-3-one
3-(2,6-dimethyl-4-oxopyran-3-yl)-3-methoxyprop-2-enoic acid
(2s)-4-(2,3-dihydroxyphenyl)-2-methyl-4-oxobutanoic acid
(3r)-4-(2,3-dihydroxyphenyl)-3-methyl-4-oxobutanoic acid
3,6,9-trihydroxy-3-methyl-1h,4h-cyclohepta[c]pyran-7-one
4-hydroxy-5-(2-hydroxyethyl)-6-methoxy-3h-2-benzofuran-1-one
1-[(2s,3s)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl]ethanone
5-(hydroxymethyl)-4-methoxy-6-oxo-2-(prop-1-en-1-yl)pyran-3-carbaldehyde
(3s)-3,6,9-trihydroxy-3-methyl-1h,4h-cyclohepta[c]pyran-7-one
5-hydroxy-4-methoxy-7-methyl-8-methylidene-5h,7h-pyrano[3,2-c]pyran-2-one
11-hydroxy-2-methyl-6-methylidene-4,7-dioxatricyclo[6.3.0.0¹,⁵]undecane-3,10-dione
3-(4-methoxy-5-methyl-6-oxopyran-2-yl)-2-methylprop-2-enoic acid
(4s,5r,6r,10r)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
(3r)-3,5-dihydroxy-6-methoxy-3-methyl-1h-2-benzopyran-4-one
3,5-dihydroxy-7-methoxy-4,6-dimethyl-3h-2-benzofuran-1-one
(4r)-6,8-dihydroxy-4-[(1s)-1-hydroxyethyl]-3,4-dihydro-2-benzopyran-1-one
2-hydroxyethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate
(2-acetyl-3,5-dihydroxy-4-methylphenyl)acetic acid
5,6,8-trihydroxy-3-(hydroxymethyl)isochromen-1-one
(1r,5r,7r,10r,11s)-10-hydroxy-11-methyl-4-methylidene-3,6-dioxatricyclo[5.3.1.0¹,⁵]undecane-2,9-dione
5-(1,5,6-trihydroxy-5-methylhex-3-yn-2-ylidene)furan-2-one
4-[4-hydroxy-5-(3-hydroxyprop-1-en-1-yl)-2-oxooxolan-3-ylidene]but-2-enal
(3r)-3-[(1r,2s)-1,2-dihydroxypropyl]-6-hydroxy-3h-2-benzofuran-1-one
3,4-dihydroxy-2-methoxy-6-(2-oxopropyl)benzaldehyde
4,8-dihydroxy-5-(hydroxymethyl)-3-methyl-3,4-dihydro-2-benzopyran-1-one
3-(1,2-dihydroxypropyl)-6-hydroxy-3h-2-benzofuran-1-one
(3s)-4-(2,3-dihydroxyphenyl)-3-methyl-4-oxobutanoic acid
(4r,5r,6s,10r)-4,6-dihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]dec-8-ene-1,7-dione
11-chlorododeca-2,4,6,8,10-pentaenoic acid
C12H13ClO2 (224.06040280000002)