Exact Mass: 172.0648026

Exact Mass Matches: 172.0648026

Found 500 metabolites which its exact mass value is equals to given mass value 172.0648026, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Menadione

Vitamin K3: 1,4-dihydro-1,4-dioxo-2-methylnaphthalene

C11H8O2 (172.0524268)


Menadione is a synthetic naphthoquinone without the isoprenoid side chain and biological activity, but can be converted to active vitamin K2, menaquinone, after alkylation in vivo. -- Pubchem; Despite the fact that it can serve as a precursor to various types of vitamin K, menadione is generally not used as a nutritional supplement. Large doses of menadione have been reported to cause adverse outcomes including hemolytic anemia due to G6PD deficiency, neonatal brain or liver damage, or neonatal death in some cases. Moreover, menadione supplements have been banned by the FDA because of their high toxicity. It is sometimes called vitamin K3, although derivatives of naphthoquinone without the sidechain in the 3-position cannot exert all the functions of the K vitamins. Menadione is a vitamin precursor of K2 which utilizes alkylation in the liver to yield menaquinones (MK-n, n=1-13; K2 vitamers), and hence, is better classified as a provitamin. -- Wikipedia. B - Blood and blood forming organs > B02 - Antihemorrhagics > B02B - Vitamin k and other hemostatics > B02BA - Vitamin k D006401 - Hematologic Agents > D003029 - Coagulants > D006490 - Hemostatics D050299 - Fibrin Modulating Agents > D000933 - Antifibrinolytic Agents D018977 - Micronutrients > D014815 - Vitamins Prothrombogenic vitamin (synthetic) Menadione is a naphthoquinone that is converted into active vitamin K2 in the body. Menadione is a naphthoquinone that is converted into active vitamin K2 in the body.

   

naphthoic acid

1-NAPHTHOIC ACID

C11H8O2 (172.0524268)


A naphthoic acid carrying a carboxy group at position 1.

   

2-Naphthoic acid

2-Naphthoic acid, palladium (2+) salt

C11H8O2 (172.0524268)


CONFIDENCE standard compound; INTERNAL_ID 48

   

Hydantoin-5-propionic acid

3-(2,5-Dioxo-imidazolidin-4-yl)-propionic acid

C6H8N2O4 (172.0484048)


Hydantoin-5-propionic acid is a metabolite of histidine, urinary hydantoin-5-propionic acid occur in patients with disorders of folate/ vitamin B12 metabolism (PMID: 3760095). Folic acid non-dependent excessive formiminoglutamic aciduria (Figlu-uria) is an extremely rare disorder; treatment with oral folate supplements (15 mg/day) for 3 weeks failed to reduce urinary hydantoin-5-propionic acid (PMID: 8487495). A metabolite of histidine, urinary hydantoin-5-propionic acid occur in patients with disorders of folate/ vitamin B12 metabolism (PMID: 3760095) 5-Hydantoinpropionic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=5624-26-0 (retrieved 2024-07-01) (CAS RN: 5624-26-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   

Methyl (Z)-2-decene-4,6,8-triynoate

Dehydromatricaria methyl ester, 1-(14)C-labeled

C11H8O2 (172.0524268)


Methyl (Z)-2-decene-4,6,8-triynoate occurs in Artemisia vulgaris (mugwort). Occurs in Artemisia vulgaris (mugwort)

   

1-Hydroxy-2-naphthaldehyde

1-Hydroxy-2-naphthaldehyde

C11H8O2 (172.0524268)


   

(R)-AMAA

(R)-2-Amino-2-(3-hydroxy-5-methyl-4-isoxazolyl)acetic acid

C6H8N2O4 (172.0484048)


   

Capillone

1-Phenyl-2,4-hexadiene-1-one

C12H12O (172.08881019999998)


   

L-alpha-Amino-5-oxo-2(5H)-isoxazolepropanoic acid

2-amino-3-(5-oxo-2,5-dihydro-1,2-oxazol-2-yl)propanoic acid

C6H8N2O4 (172.0484048)


L-alpha-Amino-5-oxo-2(5H)-isoxazolepropanoic acid is found in pulses. L-alpha-Amino-5-oxo-2(5H)-isoxazolepropanoic acid is a amino acid from the roots of pea seedlings (Pisum species Amino acid from the roots of pea seedlings (Pisum subspecies). L-alpha-Amino-5-oxo-2(5H)-isoxazolepropanoic acid is found in pulses.

   

3-(5-oxoisoxazolin-4-yl)-L-alanine

3-(5-oxoisoxazolin-4-yl)-L-alanine

C6H8N2O4 (172.0484048)


   

(Z)-2-Decene-4,6,8-triynoic acid methylester

2-Decene-4,6,8-triynoic acid, methyl ester, (Z)-

C11H8O2 (172.0524268)


   

Glycylproline

(2S)-1-(2-aminoacetyl)pyrrolidine-2-carboxylic acid

C7H12N2O3 (172.0847882)


Glycylproline is an end product of collagen metabolism that is further cleaved by prolidase (EC 3.4.13.9); the resulting proline molecules are recycled into collagen or other proteins. Prolidase deficiency is a rare autosomal recessive disease characterized by chronic ulcerative dermatitis, mental retardation, frequent infections and massive urinary excretion of iminodipeptides. The disease has been confirmed to be due to hereditary prolidase deficiency. It has been reported that the activity of the enzyme against glycylproline (Gly-Pro) is almost totally deficient in patients with prolidase deficiency, whereas the activity against other substrates is not so deficient. Some patients with prolidase deficiency have a marked urinary excretion of the iminodipeptide Glycylproline. The urine from patients with pressure sores contains significantly more Glycylproline than the urine from the control. (PMID: 16009141, 7629169, 1536787, 10582130) [HMDB] Glycylproline is a dipeptide composed of glycine and proline, and is an end product of collagen metabolism that is further cleaved by prolidase (EC 3.4.13.9). The resulting proline molecules are recycled into collagen or other proteins. Prolidase deficiency is a rare autosomal recessive disease characterized by chronic ulcerative dermatitis, mental retardation, frequent infections, and massive urinary excretion of iminodipeptides. Patients with this disease have reportedly decreased prolidase enzyme activity against glycylproline (Gly-Pro). The enzymes activity against other substrates is not as affected. Some patients with prolidase deficiency have a marked urinary excretion of glycylproline. Patients with pressure sores contain significantly more urinary glycylproline than the control (PMID: 16009141, 7629169, 1536787, 10582130). H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase.

   

Prolylglycine

2-{[(2S)-pyrrolidin-2-yl]formamido}acetic acid

C7H12N2O3 (172.0847882)


Prolylglycine is a dipeptide composed of proline and glycine. 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. It is found in urine (PMID: 3782411). L-Prolylglycine is an endogenous metabolite.

   

Diethyl fumarate

2-Butenedioic acid (e)-, diethyl ester (9ci)

C8H12O4 (172.0735552)


Diethyl fumarate is a fungal growth inhibitor for tomato juice. Flavouring compound [Superscent] Diethyl fumarate is a decomposition product of Malathion (an insecticide). Diethyl fumarate is a reputed skin irritant. Diethyl fumarate can causes non-immunologic contact urticaria on skin[1][2].

   

3-Acetyl-2,7-naphthyridine

1-(2,7-Naphthyridin-3-yl)ethanone, 9ci

C10H8N2O (172.06365979999998)


3-Acetyl-2,7-naphthyridine is found in fats and oils. 3-Acetyl-2,7-naphthyridine is an alkaloid from valerian (Valeriana officinalis). Alkaloid from valerian (Valeriana officinalis). 3-Acetyl-2,7-naphthyridine is found in tea, fats and oils, and herbs and spices.

   

4-Hydroxy-1H-indole-3-acetonitrile

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

C10H8N2O (172.06365979999998)


4-Hydroxy-1H-indole-3-acetonitrile is found in brassicas. 4-Hydroxy-1H-indole-3-acetonitrile is present in rapeseed and in cooked Brassica vegetables as a glucosinolate decomposition product. 4-Hydroxy-1H-indole-3-acetonitrile is formed from 4-Hydroxyindol-3-ylmethyl glucosinolate LBB03-D. Present in rapeseed and in cooked Brassica vegetables as a glucosinolate dec. product. Formed from 4-Hydroxyindol-3-ylmethyl glucosinolate LBB03-D. 4-Hydroxy-1H-indole-3-acetonitrile is found in brassicas.

   

Cinnamylideneacetone

(3E,5E)-6-Phenyl-3,5-hexadien-2-one

C12H12O (172.08881019999998)


Cinnamylideneacetone is found in beverages. Cinnamylideneacetone is found in kava (Piper methysticum). FDA advises against use of kava in food due to potential risk of severe liver damage (2002

   

2-Octenedioic acid

1-Hexene-1,6-dicarboxylic acid

C8H12O4 (172.0735552)


2-Octenedioic acid is an unsaturated dicarboxylic acid found in the urine of persons with abnormal fatty acid metabolism, such as patients with Dicarboxylic aciduria (PMID 2094705, 2614263). [HMDB] 2-Octenedioic acid is an unsaturated dicarboxylic acid found in the urine of persons with abnormal fatty acid metabolism, such as patients with Dicarboxylic aciduria (PMID 2094705, 2614263).

   

cis-4-Octenedioic acid

cis-4-Octene-1,8-dioic acid

C8H12O4 (172.0735552)


cis-4-Octenedioic acid, also known as (Z)-4-octene-1,8-dioate, belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups. cis-4-Octenedioic acid is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. 4-Octenedioic acid have been found slightly elevated in the urine of persons with abnormal fatty acid metabolism (PMID 2094705) [HMDB]

   

trans-3-Octenedioic acid

trans-3-Octene -1,8-dioic acid

C8H12O4 (172.0735552)


trans-3-Octenedioic acid is a mono-unsaturated dicarboxylic acid and isomer of octenedioic acids. Octenedioic acids can be derived from the oxidation of oleic and linoleic acids and are a urinary metabolites occurring in patients with dicarboxylic aciduria.(PMID: 2271537) [HMDB] trans-3-Octenedioic acid is a mono-unsaturated dicarboxylic acid and isomer of octenedioic acids. Octenedioic acids can be derived from the oxidation of oleic and linoleic acids and are a urinary metabolites occurring in patients with dicarboxylic aciduria.(PMID: 2271537).

   

2-Ethoxynaphthalene

Ethyl beta-naphthyl ether

C12H12O (172.08881019999998)


2-Ethoxynaphthalene is a flavouring ingredien Flavouring ingredient

   

3-Isopropenylpentanedioic acid

3-(prop-1-en-2-yl)pentanedioic acid

C8H12O4 (172.0735552)


3-Isopropenylpentanedioic acid is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

   

Ethyl 2,4-dioxohexanoate

Hexanoic acid, 2,4-dioxo-, ethyl ester

C8H12O4 (172.0735552)


Ethyl 2,4-dioxohexanoate is a flavouring ingredien Flavouring ingredient

   

2-Hydroxy-1-naphthaldehyde

2-Hydroxy-1-naphthalenecarboxaldehyde

C11H8O2 (172.0524268)


CFL-137 is a potent KRasG12C inhibitor. CFL-137 shows an antiproliferative effect. CFL-137 shows anticancer activity. CFL-137 has the potential for the research of lung cancer[1].

   

3-Phenyl-1H-pyrazole-4-carbaldehyde

5-phenyl-1H-pyrazole-4-carbaldehyde

C10H8N2O (172.06365979999998)


   

1,2-Cyclohexanedicarboxylic acid

cyclohexane-1,2-dicarboxylic acid

C8H12O4 (172.0735552)


   

2-Butenedioic acid (2E)-, 1,4-diethyl ester

2-Butenedioic acid (2E)-, 1,4-diethyl ester

C8H12O4 (172.0735552)


   

Glycyl-D-proline

1-(2-aminoacetyl)pyrrolidine-2-carboxylic acid

C7H12N2O3 (172.0847882)


   
   

2,3-Diethylbut-2-enedioic acid

2,3-Diethylbut-2-enedioic acid

C8H12O4 (172.0735552)


   
   

4-Chloro-1-methyl-2H-pyridine-3-carboxamide

4-Chloro-1-methyl-1,2-dihydropyridine-3-carboximidate

C7H9ClN2O (172.0403374)


   

7YYD00RL0S

Chuanxiongzine hydrochloride;Tetramethylpyrazine hydrochloride

C8H13ClN2 (172.0767208)


   

ligustrazine

Chuanxiongzine hydrochloride;Tetramethylpyrazine hydrochloride

C8H12N2.HCl (172.0767208)


   

2-chloro-5-imino-2,3,5,7a-tetrahydro-1H-pyrrolizin-7a-ol

2-chloro-5-imino-2,3,5,7a-tetrahydro-1H-pyrrolizin-7a-ol

C7H9ClN2O (172.0403374)


   
   
   
   

6-Methyl-1,4-naphthoquinone

6-Methyl-1,4-naphthoquinone

C11H8O2 (172.0524268)


   

4-(furan-3-yl)benzaldehyde

4-(furan-3-yl)benzaldehyde

C11H8O2 (172.0524268)


   

2Z-Dehydromatricaria ester

2Z-Dehydromatricaria ester

C11H8O2 (172.0524268)


   

menadione

2-Methyl-1,4-naphthoquinone

C11H8O2 (172.0524268)


A member of the class of 1,4-naphthoquinones that is 1,4-naphthoquinone which is substituted at position 2 by a methyl group. It is used as a nutritional supplement and for the treatment of hypoprothrombinemia. B - Blood and blood forming organs > B02 - Antihemorrhagics > B02B - Vitamin k and other hemostatics > B02BA - Vitamin k D006401 - Hematologic Agents > D003029 - Coagulants > D006490 - Hemostatics D050299 - Fibrin Modulating Agents > D000933 - Antifibrinolytic Agents D018977 - Micronutrients > D014815 - Vitamins Menadione is a naphthoquinone that is converted into active vitamin K2 in the body. Menadione is a naphthoquinone that is converted into active vitamin K2 in the body.

   

5-hydroxy-4-(hydroxymethyl)hexahydro-2H-cyclopenta[b]furan-2-one

5-hydroxy-4-(hydroxymethyl)hexahydro-2H-cyclopenta[b]furan-2-one

C8H12O4 (172.0735552)


   
   

5-(2-phenylethenyl)-2H-tetrazole

5-(2-phenylethenyl)-2H-tetrazole

C9H8N4 (172.0748928)


   
   

cis-Hexahydroterephthalic acid

Trans-1,4-Cyclohexanedicarboxylic Acid

C8H12O4 (172.0735552)


   

2-Hydroxy-naphthaldehyde

1-naphthalenecarboxaldehyde, 2-hydroxy

C11H8O2 (172.0524268)


CONFIDENCE standard compound; INTERNAL_ID 13 CFL-137 is a potent KRasG12C inhibitor. CFL-137 shows an antiproliferative effect. CFL-137 shows anticancer activity. CFL-137 has the potential for the research of lung cancer[1].

   

5,6-Dihydropenicillic acid

5,6-Dihydropenicillic acid

C8H12O4 (172.0735552)


   
   
   

(+)-dodec-4t-ene-6,8,10-triyn-3-ol|Dodec-trans-4-en-6.8.10-triyn-3-ol

(+)-dodec-4t-ene-6,8,10-triyn-3-ol|Dodec-trans-4-en-6.8.10-triyn-3-ol

C12H12O (172.08881019999998)


   

(Z)-3-Undecene-5,7,10-triynoic acid

(Z)-3-Undecene-5,7,10-triynoic acid

C11H8O2 (172.0524268)


   
   

2,4,8-trihydroxybicyclo[3.2.1]octan-3-one

2,4,8-trihydroxybicyclo[3.2.1]octan-3-one

C8H12O4 (172.0735552)


   

dodeca-3t,5t,7t-triene-9,11-diyn-1-ol|Dodecadiin-(9.11)-trien-(3t.5t.7t)-ol-(1)

dodeca-3t,5t,7t-triene-9,11-diyn-1-ol|Dodecadiin-(9.11)-trien-(3t.5t.7t)-ol-(1)

C12H12O (172.08881019999998)


   

Drosophilin D (cis-Undeca-3,9,10-trien-5,7-diinsaeure)|Undeca-3c,9,10-trien-5,7-diinsaeure|undeca-3c,9,10-triene-5,7-diynoic acid

Drosophilin D (cis-Undeca-3,9,10-trien-5,7-diinsaeure)|Undeca-3c,9,10-trien-5,7-diinsaeure|undeca-3c,9,10-triene-5,7-diynoic acid

C11H8O2 (172.0524268)


   

2,4-dimethoxy-2-methyl-6h-pyran-3-one

2,4-dimethoxy-2-methyl-6h-pyran-3-one

C8H12O4 (172.0735552)


   

2-Cyanoglutamic acid

2-Cyanoglutamic acid

C6H8N2O4 (172.0484048)


   

4,8-dimethyl-1,5-dioxocane-2,6-dione

4,8-dimethyl-1,5-dioxocane-2,6-dione

C8H12O4 (172.0735552)


   

6-phenyl-2H-pyran-2-one

6-phenyl-2H-pyran-2-one

C11H8O2 (172.0524268)


   

(1S,2R,5S,6R)-5,6-dihydroxy-2-methylcyclohex-3-enecarboxylic acid|massarigenin E

(1S,2R,5S,6R)-5,6-dihydroxy-2-methylcyclohex-3-enecarboxylic acid|massarigenin E

C8H12O4 (172.0735552)


   
   

rel-(4R,5S)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-enone

rel-(4R,5S)-4,5-dihydroxy-3-methoxy-5-methylcyclohex-2-enone

C8H12O4 (172.0735552)


   
   

5-acetyloxy-3-methylpent-2-enoic acid

5-acetyloxy-3-methylpent-2-enoic acid

C8H12O4 (172.0735552)


   

dodeca-2,4,10-triene-6,8-diyn-1-ol

dodeca-2,4,10-triene-6,8-diyn-1-ol

C12H12O (172.08881019999998)


   

2-phenyl-4H-pyran-4-one

2-phenyl-4H-pyran-4-one

C11H8O2 (172.0524268)


   

2-(1-hydroxy-4-oxocyclohexyl)acetic acid

2-(1-hydroxy-4-oxocyclohexyl)acetic acid

C8H12O4 (172.0735552)


   

2-{4-hydroxy-7-oxabicyclo[2.2.1]heptanyl}acetic acid

2-{4-hydroxy-7-oxabicyclo[2.2.1]heptanyl}acetic acid

C8H12O4 (172.0735552)


   

4,6-dihydroxy-6-(2-hydroxyethyl)cyclohex-2-en-1-one

4,6-dihydroxy-6-(2-hydroxyethyl)cyclohex-2-en-1-one

C8H12O4 (172.0735552)


   
   

5-Hepta-1,2-dien-4,6-diinyl-dihydro-furan-2-on|5-hepta-1,2-diene-4,6-diynyl-dihydro-furan-2-one|Nemotin

5-Hepta-1,2-dien-4,6-diinyl-dihydro-furan-2-on|5-hepta-1,2-diene-4,6-diynyl-dihydro-furan-2-one|Nemotin

C11H8O2 (172.0524268)


   

1,2,3-propanetriol, 1-(5-methyl-3-furanyl)-

1,2,3-propanetriol, 1-(5-methyl-3-furanyl)-

C8H12O4 (172.0735552)


   
   

5-Methyl-1,4-naphthoquinone

5-Methyl-1,4-naphthoquinone

C11H8O2 (172.0524268)


   

Methyl 4,6-dioxoheptanoate

Methyl 4,6-dioxoheptanoate

C8H12O4 (172.0735552)


   

2-(1-Methylethylidene)pentanedioic acid

2-(1-Methylethylidene)pentanedioic acid

C8H12O4 (172.0735552)


   

2,3-Methylenedioxynaphthalene

2,3-Methylenedioxynaphthalene

C11H8O2 (172.0524268)


   

Drosophilin C (cis-Undec-3-en-5,7,10-triinsaeure)|Undec-3c-en-5,7,10-triinsaeure|undec-3c-ene-5,7,10-triynoic acid

Drosophilin C (cis-Undec-3-en-5,7,10-triinsaeure)|Undec-3c-en-5,7,10-triinsaeure|undec-3c-ene-5,7,10-triynoic acid

C11H8O2 (172.0524268)


   
   

3,7-Dimethyl-1H-indene-5-carboxaldehyde|3,7-dimethylindene-5-carboxaldehyde

3,7-Dimethyl-1H-indene-5-carboxaldehyde|3,7-dimethylindene-5-carboxaldehyde

C12H12O (172.08881019999998)


   

1-phenyl-4-hexynone|1-Phenyl-hex-4-in-1-on|1-phenyl-hex-4-yn-1-one|1-phenylhex-4-yn-1-one|capillon

1-phenyl-4-hexynone|1-Phenyl-hex-4-in-1-on|1-phenyl-hex-4-yn-1-one|1-phenylhex-4-yn-1-one|capillon

C12H12O (172.08881019999998)


   

2-hydroxy-2-(1H-indol-3-yl)acetonitrile

2-hydroxy-2-(1H-indol-3-yl)acetonitrile

C10H8N2O (172.06365979999998)


   

H-Gly-Pro-OH

Glycyl-L-proline

C7H12N2O3 (172.0847882)


Acquisition and generation of the data is financially supported in part by CREST/JST. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase.

   

3-[(E)-prop-1-enyl]pentanedioic acid

NCGC00381342-01!3-[(E)-prop-1-enyl]pentanedioic acid

C8H12O4 (172.0735552)


   

2-Octenedioic acid

2-Octenedioic acid

C8H12O4 (172.0735552)


   

Glycylproline

Glycylproline

C7H12N2O3 (172.0847882)


H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase. H-Gly-Pro-OH is an end product of collagen metabolism that is further cleaved by prolidase.

   

cis-4-octenedioic acid

cis-4-octenedioic acid

C8H12O4 (172.0735552)


   

1,4-CYCLOHEXANEDICARBOXYLIC ACID

1,4-CYCLOHEXANEDICARBOXYLIC ACID

C8H12O4 (172.0735552)


   

1-Methylnicotinamide chloride

1-Methylnicotinamide chloride

C7H9ClN2O (172.0403374)


   

Glycyl-Proline; AIF; CE0; CorrDec

Glycyl-Proline; AIF; CE0; CorrDec

C7H12N2O3 (172.0847882)


   

Glycyl-Proline; AIF; CE10; CorrDec

Glycyl-Proline; AIF; CE10; CorrDec

C7H12N2O3 (172.0847882)


   

Glycyl-Proline; AIF; CE30; CorrDec

Glycyl-Proline; AIF; CE30; CorrDec

C7H12N2O3 (172.0847882)


   

Glycyl-Proline; AIF; CE0; MS2Dec

Glycyl-Proline; AIF; CE0; MS2Dec

C7H12N2O3 (172.0847882)


   

Glycyl-Proline; AIF; CE10; MS2Dec

Glycyl-Proline; AIF; CE10; MS2Dec

C7H12N2O3 (172.0847882)


   

Glycyl-Proline; AIF; CE30; MS2Dec

Glycyl-Proline; AIF; CE30; MS2Dec

C7H12N2O3 (172.0847882)


   

Glycyl-proline; LC-tDDA; CE10

Glycyl-proline; LC-tDDA; CE10

C7H12N2O3 (172.0847882)


   

Glycyl-proline; LC-tDDA; CE20

Glycyl-proline; LC-tDDA; CE20

C7H12N2O3 (172.0847882)


   

Glycyl-proline; LC-tDDA; CE30

Glycyl-proline; LC-tDDA; CE30

C7H12N2O3 (172.0847882)


   

Glycyl-proline; LC-tDDA; CE40

Glycyl-proline; LC-tDDA; CE40

C7H12N2O3 (172.0847882)


   
   

5,6-dihydropenicillic acid_major

5,6-dihydropenicillic acid_major

C8H12O4 (172.0735552)


   

MENADIONE_major

MENADIONE_major

C11H8O2 (172.0524268)


   
   
   

5-δ-Hydroxybutyl Hydantoin

5-(4-Hydroxybutyl)imidazolidine-2,4-dione

C7H12N2O3 (172.0847882)


   

4Z-octenedioic acid

cis-4-octenedioic acid

C8H12O4 (172.0735552)


   

2-Octenedioate

1-Hexene-1,6-dicarboxylic acid

C8H12O4 (172.0735552)


   

4-Octenedioic acid

4-Octenedioic acid

C8H12O4 (172.0735552)


   

Pro-Gly

L-prolyl-L-glycine

C7H12N2O3 (172.0847882)


A dipeptide formed from L-proline and glycine residues. L-Prolylglycine is an endogenous metabolite.

   

(-)-Corey lactone diol

(3aR,4S,5R,6aS)-hexahydro-5-hydroxy-4-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one

C8H12O4 (172.0735552)


   

3Z-Undecene-5,7,10-triynoic acid

3Z-Undecene-5,7,10-triynoic acid

C11H8O2 (172.0524268)


   

4E-Undecene-6,8,10-triynoic acid

4E-Undecene-6,8,10-triynoic acid

C11H8O2 (172.0524268)


   

4,7-dioxo-octanoic acid

4,7-dioxo-octanoic acid

C8H12O4 (172.0735552)


   

Neroline

Ethyl beta-naphthyl ether

C12H12O (172.08881019999998)


   

Cinnamylideneacetone

(3E,5E)-6-Phenyl-3,5-hexadien-2-one

C12H12O (172.08881019999998)


   

3-Isopropenylpentanedioic acid

3-(prop-1-en-2-yl)pentanedioic acid

C8H12O4 (172.0735552)


   

Bioya

2-amino-3-(5-oxo-2,5-dihydro-1,2-oxazol-2-yl)propanoic acid

C6H8N2O4 (172.0484048)


   

FEMA 3278

Hexanoic acid, 2,4-dioxo-, ethyl ester

C8H12O4 (172.0735552)


   

Naphthyridylmethylketone

1-(2,7-Naphthyridin-3-yl)ethanone, 9ci

C10H8N2O (172.06365979999998)


   

3-(Cyanomethyl)-4-hydroxyindole

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

C10H8N2O (172.06365979999998)


   

Ethyl maleate

2-Butenedioic acid (e)-, diethyl ester (9ci)

C8H12O4 (172.0735552)


Diethyl fumarate is a decomposition product of Malathion (an insecticide). Diethyl fumarate is a reputed skin irritant. Diethyl fumarate can causes non-immunologic contact urticaria on skin[1][2].

   

FA 11:7

3Z,9,10-undecatriene-5,7-diynoic acid

C11H8O2 (172.0524268)


   

FA 8:2;O2

4,7-dioxo-octanoic acid

C8H12O4 (172.0735552)


   

Nemotin

Undeca-5,6-diene-8,10-diyn-4-olide

C11H8O2 (172.0524268)


   

SFE 11:7

methyl (2E)-dec-2-en-4,6,8-triynoate

C11H8O2 (172.0524268)


   

cis-DME

methyl dec-2Z-en-4,6,8-triynoate

C11H8O2 (172.0524268)


   

NAPHTHALENE, 2-METHOXY-1-METHYL-

NAPHTHALENE, 2-METHOXY-1-METHYL-

C12H12O (172.08881019999998)


   
   

5-chloro-2-ethoxypyridin-3-amine

5-chloro-2-ethoxypyridin-3-amine

C7H9ClN2O (172.0403374)


   

Oct-4-enedioic acid

Oct-4-enedioic acid

C8H12O4 (172.0735552)


   

cis-3-carbomethoxycyclopentane-1-carboxylic acid

cis-3-carbomethoxycyclopentane-1-carboxylic acid

C8H12O4 (172.0735552)


   

(1H-BENZOIMIDAZOL-2-YL)-ACETICACIDHYDRAZIDE

(1H-BENZOIMIDAZOL-2-YL)-ACETICACIDHYDRAZIDE

C10H8N2O (172.06365979999998)


   

3-(2,5-Difluorophenyl)-1-propanol

3-(2,5-Difluorophenyl)-1-propanol

C9H10F2O (172.0699674)


   
   

1,3-DIMETHYL-6-FLUOROTHYMINE

1,3-DIMETHYL-6-FLUOROTHYMINE

C7H9FN2O2 (172.0648026)


   

sodium,2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate

sodium,2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate

C6H9D4NaO2Si (172.08335651200002)


   
   

Cyclopentylhydrazine Dihydrochloride

Cyclopentylhydrazine Dihydrochloride

C5H14Cl2N2 (172.0533984)


   
   

2-Butenoic acid,3-[(aminocarbonyl)amino]-, ethyl ester

2-Butenoic acid,3-[(aminocarbonyl)amino]-, ethyl ester

C7H12N2O3 (172.0847882)


   

CIS-2-(METHOXYCARBONYL)CYCLOPENTANECARBOXYLIC ACID

CIS-2-(METHOXYCARBONYL)CYCLOPENTANECARBOXYLIC ACID

C8H12O4 (172.0735552)


   

(R)-(-)-(2,2-DIMETHYL-[1,3]-DIOXOLAN-4-YL)-METHYLAMINE

(R)-(-)-(2,2-DIMETHYL-[1,3]-DIOXOLAN-4-YL)-METHYLAMINE

C3H12N2O4S (172.0517752)


   

2-Naphthalenecarboxaldehyde,3-hydroxy-

2-Naphthalenecarboxaldehyde,3-hydroxy-

C11H8O2 (172.0524268)


   

2-(2-Chloro-5-pyrimidinyl)-2-propanol

2-(2-Chloro-5-pyrimidinyl)-2-propanol

C7H9ClN2O (172.0403374)


   
   

(5-chloro-6-methoxypyridin-3-yl)methanamine

(5-chloro-6-methoxypyridin-3-yl)methanamine

C7H9ClN2O (172.0403374)


   

1,4-diacetoxy-2-butene

1,4-diacetoxy-2-butene

C8H12O4 (172.0735552)


   

1-Piperazinecarboxylicacid,3-oxo-,ethylester(9CI)

1-Piperazinecarboxylicacid,3-oxo-,ethylester(9CI)

C7H12N2O3 (172.0847882)


   

(2R)-1-(Chloroacetyl)-2-pyrrolidinecarbonitrile

(2R)-1-(Chloroacetyl)-2-pyrrolidinecarbonitrile

C7H9ClN2O (172.0403374)


   

(4Z)-4-(ETHOXYMETHYLENE)ISOQUINOLINE-1,3(2H,4H)-DIONE

(4Z)-4-(ETHOXYMETHYLENE)ISOQUINOLINE-1,3(2H,4H)-DIONE

C8H12O4 (172.0735552)


   

2,4-difluorobenzoic acid hydrazide

2,4-difluorobenzoic acid hydrazide

C7H6F2N2O (172.04481699999997)


   

1,2-DIFLUORO-4-ISOPROPOXYBENZENE

1,2-DIFLUORO-4-ISOPROPOXYBENZENE

C9H10F2O (172.0699674)


   

3,4-Dimethylphenylhydrazine hydrochloride

3,4-Dimethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767208)


   

2-(furan-2-yl)benzaldehyde

2-(furan-2-yl)benzaldehyde

C11H8O2 (172.0524268)


   

3-FURAN-2-YL-BENZALDEHYDE

3-FURAN-2-YL-BENZALDEHYDE

C11H8O2 (172.0524268)


   
   

2-AMINO-4-METHOXY-6-METHYLTHIO-S-TRIAZINE

2-AMINO-4-METHOXY-6-METHYLTHIO-S-TRIAZINE

C5H8N4OS (172.04187979999998)


   

2,4-DIFLUORO-N-HYDROXYBENZENECARBOXIMIDAMIDE

2,4-DIFLUORO-N-HYDROXYBENZENECARBOXIMIDAMIDE

C7H6F2N2O (172.04481699999997)


   

2-Chloro-3-(ethoxymethyl)pyrazine

2-Chloro-3-(ethoxymethyl)pyrazine

C7H9ClN2O (172.0403374)


   

3-Chloro-6-ethoxymethyl-pyridazine

3-Chloro-6-ethoxymethyl-pyridazine

C7H9ClN2O (172.0403374)


   

(6-CHLORO-PYRIMIDIN-4-YL)-ISOPROPYL-AMINE

(6-CHLORO-PYRIMIDIN-4-YL)-ISOPROPYL-AMINE

C7H9ClN2O (172.0403374)


   

2-(ISOPROPYLAMINO-METHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

2-(ISOPROPYLAMINO-METHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

C7H9ClN2O (172.0403374)


   

Dimethyl isopropylidenemalonate

Dimethyl isopropylidenemalonate

C8H12O4 (172.0735552)


   

(5-Chloro-2-methoxyphenyl)hydrazine

(5-Chloro-2-methoxyphenyl)hydrazine

C7H9ClN2O (172.0403374)


   

Methyl 3-acetyl-4-oxopentanoate

Methyl 3-acetyl-4-oxopentanoate

C8H12O4 (172.0735552)


   

Lura

(1R,2R)-(-)-1,2-Cyclohexanedicarboxylic Acid

C8H12O4 (172.0735552)


   

1,3-Cyclohexanedicarboxylic acid

1,3-Cyclohexanedicarboxylic acid

C8H12O4 (172.0735552)


   

n-Butyl fumarate

n-Butyl fumarate

C8H12O4 (172.0735552)


   

Allyl 2,2,3,3-tetrafluoropropyl ether

Allyl 2,2,3,3-tetrafluoropropyl ether

C6H8F4O (172.05112459999998)


   

Dimethyl trans-3-Hexenedioate

3-Hexenedioic acid,1,6-dimethyl ester, (3E)-

C8H12O4 (172.0735552)


   

2-chloro-6-ethoxypyridin-4-amine

2-chloro-6-ethoxypyridin-4-amine

C7H9ClN2O (172.0403374)


   
   

Diethyl methylenemalonate

Diethyl methylenemalonate

C8H12O4 (172.0735552)


   

2-(1-methyl-3-oxo-2-piperazinyl)acetic acid

2-(1-methyl-3-oxo-2-piperazinyl)acetic acid

C7H12N2O3 (172.0847882)


   

3-Hydroxybenzamidine hydrochloride

3-Hydroxybenzamidine hydrochloride

C7H9ClN2O (172.0403374)


   

2,3-DIOXO-BUTYRIC ACID TERT-BUTYL ESTER

2,3-DIOXO-BUTYRIC ACID TERT-BUTYL ESTER

C8H12O4 (172.0735552)


   

METHYL (2,5-DIOXOIMIDAZOLIDIN-4-YL)ACETATE

METHYL (2,5-DIOXOIMIDAZOLIDIN-4-YL)ACETATE

C6H8N2O4 (172.0484048)


   

Urea,1-acetyl-3-butyryl- (4CI)

Urea,1-acetyl-3-butyryl- (4CI)

C7H12N2O3 (172.0847882)


   

POLY(VINYL ACETATE-CO-CROTONIC ACID)

POLY(VINYL ACETATE-CO-CROTONIC ACID)

C8H12O4 (172.0735552)


   
   

1-(3,5-difluorophenyl)propan-1-ol

1-(3,5-difluorophenyl)propan-1-ol

C9H10F2O (172.0699674)


   

Dimethyl 2-methylenepentanedioate

Dimethyl 2-methylenepentanedioate

C8H12O4 (172.0735552)


   

Dimethyl 3-methylpent-2-enedioate

Dimethyl 3-methylpent-2-enedioate

C8H12O4 (172.0735552)


   

Dimethyl 2-allylmalonate

Dimethyl 2-allylmalonate

C8H12O4 (172.0735552)


   

3,4-DIFLUOROBENZOIC ACID HYDRAZIDE

3,4-DIFLUOROBENZOIC ACID HYDRAZIDE

C7H6F2N2O (172.04481699999997)


   

1-Methyl-L-4,5-dihydroorotic acid

1-Methyl-L-4,5-dihydroorotic acid

C6H8N2O4 (172.0484048)


   

Lithium tetraborate

Lithium tetraborate

B4H2Li2O7 (172.0492842)


   

1-PHENYL-1H-PYRAZOLE-5-CARBALDEHYDE

1-PHENYL-1H-PYRAZOLE-5-CARBALDEHYDE

C10H8N2O (172.06365979999998)


   

Betahistine Hydrochloride

Betahistine Hydrochloride

C8H13ClN2 (172.0767208)


   
   

8-Amino-7-quinolinecarbaldehyde

8-Amino-7-quinolinecarbaldehyde

C10H8N2O (172.06365979999998)


   

5-Phenyl-2-furaldehyde

5-Phenyl-2-furaldehyde

C11H8O2 (172.0524268)


   

(2-chloro-6-methoxypyridin-3-yl)methanamine

(2-chloro-6-methoxypyridin-3-yl)methanamine

C7H9ClN2O (172.0403374)


   

(1R,3S)-3-(Methoxycarbonyl)cyclopentanecarboxylic acid

(1R,3S)-3-(Methoxycarbonyl)cyclopentanecarboxylic acid

C8H12O4 (172.0735552)


   

1-(2-Pyrrolidinyl)methanamine dihydrochloride

1-(2-Pyrrolidinyl)methanamine dihydrochloride

C5H14Cl2N2 (172.0533984)


   
   

(8-Methyl-1-naphthyl)methanol

(8-Methyl-1-naphthyl)methanol

C12H12O (172.08881019999998)


   

1-Cyclooctene-1-carbonyl chloride (6CI)

1-Cyclooctene-1-carbonyl chloride (6CI)

C9H13ClO (172.0654878)


   

2-Ethoxy-4-fluoro-6-hydrazinopyrimidine

2-Ethoxy-4-fluoro-6-hydrazinopyrimidine

C6H9FN4O (172.07603559999998)


   

2-pent-4-enylpropanedioic acid

2-pent-4-enylpropanedioic acid

C8H12O4 (172.0735552)


   

4-Hydroxynaphthalene-2-carboxaldehyde

4-Hydroxynaphthalene-2-carboxaldehyde

C11H8O2 (172.0524268)


   
   

BUT-3-ENE-1,2-DIYL DIACETATE

BUT-3-ENE-1,2-DIYL DIACETATE

C8H12O4 (172.0735552)


   

4-FURAN-2-YL-BENZALDEHYDE

4-FURAN-2-YL-BENZALDEHYDE

C11H8O2 (172.0524268)


   

ISOPROPYLHYDRAZINE SULFATE

ISOPROPYLHYDRAZINE SULFATE

C3H12N2O4S (172.0517752)


   
   

6-CHLORO-N4,N4-DIMETHYL-PYRIMIDINE-4,5-DIAMINE

6-CHLORO-N4,N4-DIMETHYL-PYRIMIDINE-4,5-DIAMINE

C6H9ClN4 (172.0515704)


   

2-(dimethylaminomethyl)-4-thiazolemethanol

2-(dimethylaminomethyl)-4-thiazolemethanol

C7H12N2OS (172.06703019999998)


   

2,3-dimethylphenylhydrazine hydrochloride

2,3-dimethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767208)


   

5-Isocyanato-1-methyl-1H-indole

5-Isocyanato-1-methyl-1H-indole

C10H8N2O (172.06365979999998)


   

2,4-Pyrimidinediamine,6-chloro-N4,N4-dimethyl-

2,4-Pyrimidinediamine,6-chloro-N4,N4-dimethyl-

C6H9ClN4 (172.0515704)


   

4-Hydroxy-1-naphthaldehyde

4-Hydroxy-1-naphthaldehyde

C11H8O2 (172.0524268)


   

2-Chloro-4-ethoxy-6-methylpyrimidine

2-Chloro-4-ethoxy-6-methylpyrimidine

C7H9ClN2O (172.0403374)


   

1-(4-HYDROXYPHENYL)-3-(2,3,4-TRIMETHOXYPHENYL)-2-PROPEN-1-ONE

1-(4-HYDROXYPHENYL)-3-(2,3,4-TRIMETHOXYPHENYL)-2-PROPEN-1-ONE

C9H7F3 (172.0499818)


   

(1S,2S)-1,2-cyclohexanedicarboxylicacid

(1S,2S)-1,2-cyclohexanedicarboxylicacid

C8H12O4 (172.0735552)


   

3-(3,4-Difluorophenyl)-1-propanol

3-(3,4-Difluorophenyl)-1-propanol

C9H10F2O (172.0699674)


   

POLY(ETHYL ACRYLATE/ACRYLIC ACID)

POLY(ETHYL ACRYLATE/ACRYLIC ACID)

C8H12O4 (172.0735552)


   
   

4-Pyridinecarboximidic acid, hydrazide HCl

4-Pyridinecarboximidic acid, hydrazide HCl

C6H9ClN4 (172.0515704)


   

4-Vinylbenzotrifluoride

4-Vinylbenzotrifluoride

C9H7F3 (172.0499818)


   

3-(1H-PYRAZOL-1-YL)BENZALDEHYDE

3-(1H-PYRAZOL-1-YL)BENZALDEHYDE

C10H8N2O (172.06365979999998)


   

5-PHENYL-1H-PYRAZOLE-3-CARBALDEHYDE

5-PHENYL-1H-PYRAZOLE-3-CARBALDEHYDE

C10H8N2O (172.06365979999998)


   

3-(1H-PYRAZOL-3-YL)BENZALDEHYDE

3-(1H-PYRAZOL-3-YL)BENZALDEHYDE

C10H8N2O (172.06365979999998)


   

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

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

C10H8N2O (172.06365979999998)


   

2-methoxy-7-methylnaphthalene

2-methoxy-7-methylnaphthalene

C12H12O (172.08881019999998)


   

2-(1H-imidazol-2-yl)benzaldehyde

2-(1H-imidazol-2-yl)benzaldehyde

C10H8N2O (172.06365979999998)


   

5-CHLOROMETHYL-1-ISOBUTYL-1H-IMIDAZOLE

5-CHLOROMETHYL-1-ISOBUTYL-1H-IMIDAZOLE

C8H13ClN2 (172.0767208)


   

n,n-dimethyl-p-phenylenediamine monohydrochloride

n,n-dimethyl-p-phenylenediamine monohydrochloride

C8H13ClN2 (172.0767208)


   

(2,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

(2,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

C8H13ClN2 (172.0767208)


   

(R)-4-(3-ISOPROPOXYPHENYL)-1,3-DIMETHYL-1,2,3,6-TETRAHYDRO-PYRIDINE

(R)-4-(3-ISOPROPOXYPHENYL)-1,3-DIMETHYL-1,2,3,6-TETRAHYDRO-PYRIDINE

C8H12O4 (172.0735552)


   

DIMETHYL 1,1-CYCLOBUTANEDICARBOXYLATE

DIMETHYL 1,1-CYCLOBUTANEDICARBOXYLATE

C8H12O4 (172.0735552)


   
   

1-Methylpiperazine dihydrochloride

1-Methylpiperazine dihydrochloride

C5H14Cl2N2 (172.0533984)


   
   

2-Phenyl-1H-imidazole-4-carbaldehyde

2-Phenyl-1H-imidazole-4-carbaldehyde

C10H8N2O (172.06365979999998)


   

[3-(Difluoromethyl)phenyl]boronic acid

[3-(Difluoromethyl)phenyl]boronic acid

C7H7BF2O2 (172.05071360000002)


   

Octanoic acid,5,7-dioxo-

Octanoic acid,5,7-dioxo-

C8H12O4 (172.0735552)


   

AG 43

2-[(4-Hydroxyphenyl)methyl]propanedinitrile

C10H8N2O (172.06365979999998)


   

cis-1,2-Cyclohexanedicarboxylic acid

cis-Cyclohexane-1,2-dicarboxylic acid

C8H12O4 (172.0735552)


   

methyl 2-[(2S)-3-oxo-2,4,5,6-tetrahydropyrazin-2-yl]acetate

methyl 2-[(2S)-3-oxo-2,4,5,6-tetrahydropyrazin-2-yl]acetate

C7H12N2O3 (172.0847882)


   

1,3,5-trimethylpyrazole-4-carbonyl chloride

1,3,5-trimethylpyrazole-4-carbonyl chloride

C7H9ClN2O (172.0403374)


   

1,3-Dinitro(2H4)benzene

1,3-Dinitro(2H4)benzene

C6D4N2O4 (172.042215112)


   

1,2-Difluoro-3-isopropoxybenzene

1,2-Difluoro-3-isopropoxybenzene

C9H10F2O (172.0699674)


   

trans-(±)-1,3-Cyclohexanedicarboxylic acid

trans-(±)-1,3-Cyclohexanedicarboxylic acid

C8H12O4 (172.0735552)


   
   

(2,5-dimethylphenyl)hydrazine hydrochloride

(2,5-dimethylphenyl)hydrazine hydrochloride

C8H13ClN2 (172.0767208)


   

ethyl 4-fluoro-5-methyl-1H-pyrazole-3-carboxylate

ethyl 4-fluoro-5-methyl-1H-pyrazole-3-carboxylate

C7H9FN2O2 (172.0648026)


   

2-Propenamide,2-cyano-3-phenyl-

2-Propenamide,2-cyano-3-phenyl-

C10H8N2O (172.06365979999998)


   

1H-Imidazole-4-carbonyl chloride, 2-propyl- (9CI)

1H-Imidazole-4-carbonyl chloride, 2-propyl- (9CI)

C7H9ClN2O (172.0403374)


   

5-ethenyl-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid

5-ethenyl-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid

C8H12O4 (172.0735552)


   

5-propyl-1H-imidazole-4-carbonyl chloride

5-propyl-1H-imidazole-4-carbonyl chloride

C7H9ClN2O (172.0403374)


   

4-Phenyl-1H-imidazole-2-carbaldehyde

4-Phenyl-1H-imidazole-2-carbaldehyde

C10H8N2O (172.06365979999998)


   
   

1-Naphthaleneboronic acid

1-Naphthaleneboronic acid

C10H9BO2 (172.0695564)


   

(S)-4-(2-AMINOCARBONYLETHYL)OXAZOLIDINE-2,5-DIONE

(S)-4-(2-AMINOCARBONYLETHYL)OXAZOLIDINE-2,5-DIONE

C6H8N2O4 (172.0484048)


   

4-Amidinophenol hydrochloride

4-Amidinophenol hydrochloride

C7H9ClN2O (172.0403374)


   

3-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

3-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

C8H13ClN2 (172.0767208)


   

2,6-DIFLUORO-N-HYDROXY-BENZAMIDINE

2,6-DIFLUORO-N-HYDROXY-BENZAMIDINE

C7H6F2N2O (172.04481699999997)


   

2-Ethylphenylhydrazine hydrochloride

2-Ethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767208)


   
   

3-Methyl-2-quinoxalinecarbaldehyde

3-Methyl-2-quinoxalinecarbaldehyde

C10H8N2O (172.06365979999998)


   

5-Amino-2-mercapto-1-methyl-1H-imidazole-4-carboxamide

5-Amino-2-mercapto-1-methyl-1H-imidazole-4-carboxamide

C5H8N4OS (172.04187979999998)


   

4-pyridin-3-ylpyrimidin-2-amine

4-pyridin-3-ylpyrimidin-2-amine

C9H8N4 (172.0748928)


   

1H-Indole-3-acetonitrile,2,3-dihydro-2-oxo-

1H-Indole-3-acetonitrile,2,3-dihydro-2-oxo-

C10H8N2O (172.06365979999998)


   

1H-Pyrazole, 1-(chloroacetyl)-3,5-dimethyl- (9CI)

1H-Pyrazole, 1-(chloroacetyl)-3,5-dimethyl- (9CI)

C7H9ClN2O (172.0403374)


   

(2Z)-2-Butene-1,4-diyl diacetate

(2Z)-2-Butene-1,4-diyl diacetate

C8H12O4 (172.0735552)


   
   

Ethyl 4-oxotetrahydro-2H-pyran-3-carboxylate

Ethyl 4-oxotetrahydro-2H-pyran-3-carboxylate

C8H12O4 (172.0735552)


   

2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBONITRILE

2-OXO-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBONITRILE

C10H8N2O (172.06365979999998)


   

Ethyl 5-hydroxy-3,6-dihydro-2H-pyran-4-carboxylate

Ethyl 5-hydroxy-3,6-dihydro-2H-pyran-4-carboxylate

C8H12O4 (172.0735552)


   

1-(2-METHOXYBENZYL)HYDRAZINE

1-(2-METHOXYBENZYL)HYDRAZINE

C6H8N2O4 (172.0484048)


   

(4-METHYL-2-PHENYL-1,3-THIAZOL-5-YL)METHANAMINE

(4-METHYL-2-PHENYL-1,3-THIAZOL-5-YL)METHANAMINE

C8H13ClN2 (172.0767208)


   
   
   

ethyl 2-acetylacetoacetate

ethyl 2-acetylacetoacetate

C8H12O4 (172.0735552)


   

(2,6-Dimethyl-4H-pyran-4-ylidene)malononitrile

(2,6-Dimethyl-4H-pyran-4-ylidene)malononitrile

C10H8N2O (172.06365979999998)


   

nicotinamide chloromethylate

3-Carbamyl-1-methylpyridinium chloride

C7H9ClN2O (172.0403374)


TRIA-662 (1-Methylnicotinamide chloride) is an endogenous metabolite. TRIA-662 shows antithrombotic and anti-inflammatory activities[1].

   

2-Propene-1,1-diol,2-methyl-, 1,1-diacetate

2-Propene-1,1-diol,2-methyl-, 1,1-diacetate

C8H12O4 (172.0735552)


   
   
   
   

4-Chloro-6-isopropoxypyrimidine

4-Chloro-6-isopropoxypyrimidine

C7H9ClN2O (172.0403374)


   

Monobutyl maleate

Monobutyl maleate

C8H12O4 (172.0735552)


   

(S)-3-Aminopiperidine dihydrochloride

(S)-3-Aminopiperidine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

(3R)-Piperidin-3-amindihydrochlorid

(3R)-Piperidin-3-amindihydrochlorid

C5H14Cl2N2 (172.0533984)


   

(R)-3-Aminopiperidine dihydrochloride

(R)-3-Aminopiperidine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

2-methyl-N-(1,3,4-thiadiazol-2-yl)propane-1,2-diamine

2-methyl-N-(1,3,4-thiadiazol-2-yl)propane-1,2-diamine

C6H12N4S (172.07826319999998)


   
   

4-FLUORO-2,6-BIS-HYDROXYMETHYL-PHENOL

4-FLUORO-2,6-BIS-HYDROXYMETHYL-PHENOL

C8H9FO3 (172.0535696)


   
   

1-(Ethoxycarbonyl)cyclobutanecarboxylic acid

1-(Ethoxycarbonyl)cyclobutanecarboxylic acid

C8H12O4 (172.0735552)


   

(2R)-2-Methylpiperazine dihydrochloride

(2R)-2-Methylpiperazine dihydrochloride

C5H14Cl2N2 (172.0533984)


   
   

6-Hydroxy-2-naphthaldehyde

6-Hydroxy-2-naphthaldehyde

C11H8O2 (172.0524268)


   

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

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

C10H8N2O (172.06365979999998)


   

1-carbamoylpiperidine-4-carboxylic acid

1-carbamoylpiperidine-4-carboxylic acid

C7H12N2O3 (172.0847882)


   

1-(aminocarbonyl)piperidine-3-carboxylic acid(SALTDATA: HCl)

1-(aminocarbonyl)piperidine-3-carboxylic acid(SALTDATA: HCl)

C7H12N2O3 (172.0847882)


   

1-(4-pyridinyl)-1H-pyrrole-2-carbaldehyde(SALTDATA: FREE)

1-(4-pyridinyl)-1H-pyrrole-2-carbaldehyde(SALTDATA: FREE)

C10H8N2O (172.06365979999998)


   

2-(Furfurylthio)ethylamine

2-(Furfurylthio)ethylamine

C7H12N2O3 (172.0847882)


   

ETHYL 4-ETHOXY-2-OXOBUT-3-ENOATE

ETHYL 4-ETHOXY-2-OXOBUT-3-ENOATE

C8H12O4 (172.0735552)


   
   

2-amino-1-pyridin-3-ylethanone,hydrochloride

2-amino-1-pyridin-3-ylethanone,hydrochloride

C7H9ClN2O (172.0403374)


   

2-Amino-4-methyl-1,3-thiazole-5-carbohydrazide

2-Amino-4-methyl-1,3-thiazole-5-carbohydrazide

C5H8N4OS (172.04187979999998)


   

ETHYL 2-ACETYL-3-HYDROXY-2-BUTENOATE

ETHYL 2-ACETYL-3-HYDROXY-2-BUTENOATE

C8H12O4 (172.0735552)


   
   
   

2,5-Dioxopyrrolidin-1-yl methylcarbamate

1-[(Methylcarbamoyl)oxy]-2,5-pyrrolidinedione

C6H8N2O4 (172.0484048)


   

2-(4-FLUOROBENZYLIDENE)-MALONONITRILE

2-(4-FLUOROBENZYLIDENE)-MALONONITRILE

C10H5FN2 (172.0436742)


   

5-Diazo-2,2-dimethyl-1,3-dioxane-4,6-dione

5-Diazo-2,2-dimethyl-1,3-dioxane-4,6-dione

C6H8N2O4 (172.0484048)


   

5,9-Methano-6,7,8,9-tetrahydro-7H-benzocycloheptene-7-one

5,9-Methano-6,7,8,9-tetrahydro-7H-benzocycloheptene-7-one

C12H12O (172.08881019999998)


   

1-(Trifluoromethyl)-3-vinylbenzene

1-(Trifluoromethyl)-3-vinylbenzene

C9H7F3 (172.0499818)


   

3S-(3a,3a,6a)]-Hexahydrofuro[2,3-b]furan-3-ol Acetate

3S-(3a,3a,6a)]-Hexahydrofuro[2,3-b]furan-3-ol Acetate

C8H12O4 (172.0735552)


   

(6-CHLORO-4-(METHYLAMINO)PYRIDIN-3-YL)METHANOL

(6-CHLORO-4-(METHYLAMINO)PYRIDIN-3-YL)METHANOL

C7H9ClN2O (172.0403374)


   

1-(1,5-Naphthyridin-3-yl)ethanone

1-(1,5-Naphthyridin-3-yl)ethanone

C10H8N2O (172.06365979999998)


   

4-amino-3-tert-butyl-1H-1,2,4-triazole-5-thione

4-amino-3-tert-butyl-1H-1,2,4-triazole-5-thione

C6H12N4S (172.07826319999998)


   

5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile

C9H8N4 (172.0748928)


   

1-Carbamoyl-piperidine-4-carboxylic acid

1-Carbamoyl-piperidine-4-carboxylic acid

C7H12N2O3 (172.0847882)


   

(1S,2S)-TRANS-1,2-CYCLOHEXANEDIOL

(1S,2S)-TRANS-1,2-CYCLOHEXANEDIOL

C8H12O4 (172.0735552)


   

METHYL 3-ACETOXY-2-METHYLENEBUTYRATE

METHYL 3-ACETOXY-2-METHYLENEBUTYRATE

C8H12O4 (172.0735552)


   

5-METHYLPYRAZINE-2-CARBOXIMIDAMIDE HYDROCHLORIDE

5-METHYLPYRAZINE-2-CARBOXIMIDAMIDE HYDROCHLORIDE

C6H9ClN4 (172.0515704)


   

2-CHLORO-4-ETHOXYMETHYL-PYRIMIDINE

2-CHLORO-4-ETHOXYMETHYL-PYRIMIDINE

C7H9ClN2O (172.0403374)


   

2-CHLORO-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE

2-CHLORO-3,5,5-TRIMETHYL-CYCLOHEX-2-ENONE

C9H13ClO (172.0654878)


   

N-Hydroxybenzenecarboximidamide hydrochloride (1:1)

N-Hydroxybenzenecarboximidamide hydrochloride (1:1)

C7H9ClN2O (172.0403374)


   
   

1H-Benzimidazole-5-carbonitrile,2-amino-1-methyl-(9CI)

1H-Benzimidazole-5-carbonitrile,2-amino-1-methyl-(9CI)

C9H8N4 (172.0748928)


   

Cyclopentanemalonic acid

Cyclopentanemalonic acid

C8H12O4 (172.0735552)


   
   

METHYL 3-METHOXY-2-OXO-1-CYCLOPENTANECARBOXYLATE

METHYL 3-METHOXY-2-OXO-1-CYCLOPENTANECARBOXYLATE

C8H12O4 (172.0735552)


   

N-(4,5-dihydro-4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)-Acetamide

N-(4,5-dihydro-4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)-Acetamide

C5H8N4OS (172.04187979999998)


   

(3,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

(3,4-Dimethylphenyl)hydrazine hydrochloride (1:1)

C8H13ClN2 (172.0767208)


   

4-(2-Aminoethyl)aniline hydrochloride (1:1)

4-(2-Aminoethyl)aniline hydrochloride (1:1)

C8H13ClN2 (172.0767208)


   
   

6-ISOCYANATO-1-METHYL-1H-INDOLE 97+

6-ISOCYANATO-1-METHYL-1H-INDOLE 97+

C10H8N2O (172.06365979999998)


   

1-(2-Fluoro-4-hydroxy-5-methoxyphenyl)ethanone

1-(2-Fluoro-4-hydroxy-5-methoxyphenyl)ethanone

C8H9FO3 (172.0535696)


   

(2S)-2-[[2-CHLORO-4-(TRIFLUOROMETHYL)PHENYL]AMINO]-3-METHYL-BUTANOATE

(2S)-2-[[2-CHLORO-4-(TRIFLUOROMETHYL)PHENYL]AMINO]-3-METHYL-BUTANOATE

C5H14Cl2N2 (172.0533984)


   

(S)-Propane-1,2-diamine sulfate

(S)-Propane-1,2-diamine sulfate

C3H12N2O4S (172.0517752)


   

Dimethyl 1,2-cyclobutanedicarboxylate

Dimethyl 1,2-cyclobutanedicarboxylate

C8H12O4 (172.0735552)


   

cis-1,2-cyclobutanedicarboxylic acid dimethyl ester

cis-1,2-cyclobutanedicarboxylic acid dimethyl ester

C8H12O4 (172.0735552)


   

(+)-Corey lactone

(+)-Corey lactone

C8H12O4 (172.0735552)


   

(3-bromothiophen-2-yl)methanol

(3-bromothiophen-2-yl)methanol

C7H9ClN2O (172.0403374)


   

2,4-Difluoro-1-isopropoxybenzene

2,4-Difluoro-1-isopropoxybenzene

C9H10F2O (172.0699674)


   

1-(2-Amino-2-oxoethyl)pyridinium chloride

1-(2-Amino-2-oxoethyl)pyridinium chloride

C7H9ClN2O (172.0403374)


   

5-BROMO-3-HYDROXY-3-(2-OXOPROPYL)-1,3-DIHYDRO-2H-INDOL-2-ONE

5-BROMO-3-HYDROXY-3-(2-OXOPROPYL)-1,3-DIHYDRO-2H-INDOL-2-ONE

C8H13ClN2 (172.0767208)


   

1-Pyridin-2-yl-1H-pyrrole-2-carbaldehyde

1-Pyridin-2-yl-1H-pyrrole-2-carbaldehyde

C10H8N2O (172.06365979999998)


   

1-PYRIDIN-3-YL-1H-PYRROLE-2-CARBALDEHYDE

1-PYRIDIN-3-YL-1H-PYRROLE-2-CARBALDEHYDE

C10H8N2O (172.06365979999998)


   

cyclohexane-1,1-dicarboxylic acid

cyclohexane-1,1-dicarboxylic acid

C8H12O4 (172.0735552)


   

2-Ethylphenyl hydrazine HCl

2-Ethylphenyl hydrazine HCl

C8H13ClN2 (172.0767208)


   

((1E,3E)-4-CHLORO-BUTA-1,3-DIENYL)-BENZENE

((1E,3E)-4-CHLORO-BUTA-1,3-DIENYL)-BENZENE

C10H5FN2 (172.0436742)


   

4-pyridin-4-ylpyrimidin-2-amine

4-pyridin-4-ylpyrimidin-2-amine

C9H8N4 (172.0748928)


   

2-(4-morpholino)ethyl isothiocyanate

2-(4-morpholino)ethyl isothiocyanate

C7H12N2OS (172.06703019999998)


   

Benzoic acid, 2,3-difluoro-, hydrazide (9CI)

Benzoic acid, 2,3-difluoro-, hydrazide (9CI)

C7H6F2N2O (172.04481699999997)


   

Pyridazine,3-chloro-6-propoxy-

Pyridazine,3-chloro-6-propoxy-

C7H9ClN2O (172.0403374)


   
   

Pralidoxime chloride

2-Pyridinealdoxime methochloride

C7H9ClN2O (172.0403374)


D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002801 - Cholinesterase Reactivators C78272 - Agent Affecting Nervous System > C47796 - Cholinergic Agonist D020011 - Protective Agents > D000931 - Antidotes D004793 - Enzyme Reactivators

   

(S)-(-)-1-(2-Naphthyl)ethanol

(S)-(-)-1-(2-Naphthyl)ethanol

C12H12O (172.08881019999998)


   

3-Hydroxynaphthalene-1-carboxaldehyde

3-Hydroxynaphthalene-1-carboxaldehyde

C11H8O2 (172.0524268)


   
   
   

1,3-dihydro-imidazol-2-one-5-methoxymethyl-4-carboxylic acid

1,3-dihydro-imidazol-2-one-5-methoxymethyl-4-carboxylic acid

C6H8N2O4 (172.0484048)


   

cyclobutylmethylhydrazine dihydrochloride

cyclobutylmethylhydrazine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

1H-Imidazole-2-carbonyl chloride, 1-propyl- (9CI)

1H-Imidazole-2-carbonyl chloride, 1-propyl- (9CI)

C7H9ClN2O (172.0403374)


   

Dihydroorotate Acid Methyl Ester

Dihydroorotate Acid Methyl Ester

C6H8N2O4 (172.0484048)


   

cis-1,3-cyclohexanedicarboxylic acid

cis-1,3-cyclohexanedicarboxylic acid

C8H12O4 (172.0735552)


   

(R)-(+)-7,7-BIS[DI(4-METHYLPHENYL)PHOSPHINO]-2,2,3,3-TETRAHYDRO-1,1-SPIROBIINDANE

(R)-(+)-7,7-BIS[DI(4-METHYLPHENYL)PHOSPHINO]-2,2,3,3-TETRAHYDRO-1,1-SPIROBIINDANE

C12H12O (172.08881019999998)


   

octylmagnesium chloride

octylmagnesium chloride

C8H17ClMg (172.0869212)


   

1-(Trifluoromethyl)-2-vinylbenzene

1-(Trifluoromethyl)-2-vinylbenzene

C9H7F3 (172.0499818)


   

1,2-Difluoro-3-propoxybenzene

1,2-Difluoro-3-propoxybenzene

C9H10F2O (172.0699674)


   

2-Hydroxy-1-naphthaldehyde

2-Hydroxy-1-naphthaldehyde

C11H8O2 (172.0524268)


   

2-Difluoromethyl-benzeneboronic acid

2-Difluoromethyl-benzeneboronic acid

C7H7BF2O2 (172.05071360000002)


   

(4-Methyl-1-naphthyl)methanol

(4-Methyl-1-naphthyl)methanol

C12H12O (172.08881019999998)


   

(3-ETHYL-PHENYL)-HYDRAZINE HYDROCHLORIDE

(3-ETHYL-PHENYL)-HYDRAZINE HYDROCHLORIDE

C8H13ClN2 (172.0767208)


   

2-pyridin-3-ylpyrimidin-4-amine

2-pyridin-3-ylpyrimidin-4-amine

C9H8N4 (172.0748928)


   

5-Methoxy-1H-indole-3-carbonitrile

5-Methoxy-1H-indole-3-carbonitrile

C10H8N2O (172.06365979999998)


   

1-Phenyl-1H-pyrazole-4-carboxaldehyde

1-Phenyl-1H-pyrazole-4-carboxaldehyde

C10H8N2O (172.06365979999998)


   

3-(trifluoromethyl)styrene

3-(trifluoromethyl)styrene

C9H7F3 (172.0499818)


   

2-chloro-4,4-dimethylcyclohex-1-enecarbaldehyde

2-chloro-4,4-dimethylcyclohex-1-enecarbaldehyde

C9H13ClO (172.0654878)


   

trans-cyclobutane-dicarboxylic acid-(1.3)-dimethyl ester

trans-cyclobutane-dicarboxylic acid-(1.3)-dimethyl ester

C8H12O4 (172.0735552)


   

1-(Chloroacetyl)-2-pyrrolidinecarbonitrile

1-(Chloroacetyl)-2-pyrrolidinecarbonitrile

C7H9ClN2O (172.0403374)


   

3-deoxy-1,2-O-isopropylidene-α-D-erythro-pentodialdo-1,4-furanose aldehyde

3-deoxy-1,2-O-isopropylidene-α-D-erythro-pentodialdo-1,4-furanose aldehyde

C8H12O4 (172.0735552)


   

4,5-dimethyl-o-phenylenediamine, dihydrochloride

4,5-dimethyl-o-phenylenediamine, dihydrochloride

C8H13ClN2 (172.0767208)


   

4,5-difluoro-2-methylphenylboronic acid

4,5-difluoro-2-methylphenylboronic acid

C7H7BF2O2 (172.05071360000002)


   
   

trans-1,3-cyclohexanedicarboxylic acid

trans-1,3-cyclohexanedicarboxylic acid

C8H12O4 (172.0735552)


   

(3-Chloro-6-Methoxypyridin-2-yl)MethanaMine

(3-Chloro-6-Methoxypyridin-2-yl)MethanaMine

C7H9ClN2O (172.0403374)


   

cis-cyclopentane-1,2-diamine dihydrochloride

cis-cyclopentane-1,2-diamine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

trans-Cyclopentane-1,3-diamine dihydrochloride

trans-Cyclopentane-1,3-diamine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

2,6-difluoro-4-propylphenol

2,6-difluoro-4-propylphenol

C9H10F2O (172.0699674)


   

(1R,2R)-trans-1,2-Cyclopentanediamine dihydrochloride

(1R,2R)-trans-1,2-Cyclopentanediamine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

Piperidin-4-amindihydrochlorid

Piperidin-4-amindihydrochlorid

C5H14Cl2N2 (172.0533984)


   

2-(4-Pyridinyl)-4-pyrimidinamine

2-(4-Pyridinyl)-4-pyrimidinamine

C9H8N4 (172.0748928)


   

2-Naphthaleneboronic acid

2-Naphthaleneboronic acid

C10H9BO2 (172.0695564)


   

(2,3-Difluoro-4-methylphenyl)boronic acid

(2,3-Difluoro-4-methylphenyl)boronic acid

C7H7BF2O2 (172.05071360000002)


   

BUT-2-ENE-1,4-DIYL DIACETATE

BUT-2-ENE-1,4-DIYL DIACETATE

C8H12O4 (172.0735552)


   

(R)-1-(Naphthalen-1-yl)ethanol

(R)-1-(Naphthalen-1-yl)ethanol

C12H12O (172.08881019999998)


   

2-Oxo-1,2,3,4-tetrahydro-7-quinolinecarbonitrile

2-Oxo-1,2,3,4-tetrahydro-7-quinolinecarbonitrile

C10H8N2O (172.06365979999998)


   

1-phenylpyrazole-3-carbaldehyde

1-phenylpyrazole-3-carbaldehyde

C10H8N2O (172.06365979999998)


   

1H-Imidazo[4,5-b]pyrazino[2,3-e]pyrazine (9CI)

1H-Imidazo[4,5-b]pyrazino[2,3-e]pyrazine (9CI)

C7H4N6 (172.0497424)


   

4-(2-Pyridinyl)-2-pyrimidinamine

4-(2-Pyridinyl)-2-pyrimidinamine

C9H8N4 (172.0748928)


   
   
   

5-AMINO-3-(METHYLTHIO)-1H-PYRAZOLE-4-CARBOXAMIDE

5-AMINO-3-(METHYLTHIO)-1H-PYRAZOLE-4-CARBOXAMIDE

C5H8N4OS (172.04187979999998)


   

1-ETHYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL CHLORIDE

1-ETHYL-3-METHYL-1H-PYRAZOLE-5-CARBONYL CHLORIDE

C7H9ClN2O (172.0403374)


   

4-aminopyrimidine-5-carbothioamide hydrate

4-aminopyrimidine-5-carbothioamide hydrate

C5H8N4OS (172.04187979999998)


   

1-Phenyl-1H-imidazole-2-carbaldehyde

1-Phenyl-1H-imidazole-2-carbaldehyde

C10H8N2O (172.06365979999998)


   

1-(Methoxymethyl)-naphthalene

1-(Methoxymethyl)-naphthalene

C12H12O (172.08881019999998)


   
   

5,5-Dimethyl-2,4-dioxo-1,3-oxazolidine-3-carboxamide

5,5-Dimethyl-2,4-dioxo-1,3-oxazolidine-3-carboxamide

C6H8N2O4 (172.0484048)


   
   

2,3-Dihydro-1H-imidazo[1,2-a]pyridin-5-one hydrochloride

2,3-Dihydro-1H-imidazo[1,2-a]pyridin-5-one hydrochloride

C7H9ClN2O (172.0403374)


   

(4-Ethylphenyl)hydrazine hydrochloride (1:1)

(4-Ethylphenyl)hydrazine hydrochloride (1:1)

C8H13ClN2 (172.0767208)


   
   

3-(1H-Imidazol-4-yl)benzaldehyde

3-(1H-Imidazol-4-yl)benzaldehyde

C10H8N2O (172.06365979999998)


   

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

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

C7H4N6 (172.0497424)


   

1-Cyclohexene-1-carbonyl chloride, 2-ethyl- (9CI)

1-Cyclohexene-1-carbonyl chloride, 2-ethyl- (9CI)

C9H13ClO (172.0654878)


   

(imidazol-4-yl)(phenyl)methanone

(imidazol-4-yl)(phenyl)methanone

C10H8N2O (172.06365979999998)


   

Ethyl 4-oxotetrahydro-2H-pyran-2-carboxylate

Ethyl 4-oxotetrahydro-2H-pyran-2-carboxylate

C8H12O4 (172.0735552)


   

[4-(Difluoromethyl)phenyl]boronic acid

[4-(Difluoromethyl)phenyl]boronic acid

C7H7BF2O2 (172.05071360000002)


   

Pyridazine,3-chloro-6-(1-methylethoxy)-

Pyridazine,3-chloro-6-(1-methylethoxy)-

C7H9ClN2O (172.0403374)


   

(2S)-1-(CHLOROACETYL)-2-PYRROLIDINECARBONITRILE

(2S)-1-(CHLOROACETYL)-2-PYRROLIDINECARBONITRILE

C7H9ClN2O (172.0403374)


   

6-Methoxy-1H-indole-3-carbonitrile

6-Methoxy-1H-indole-3-carbonitrile

C10H8N2O (172.06365979999998)


   

dimethyl 3-methyl-trans-1,2-cyclopropanedicarboxylate

dimethyl 3-methyl-trans-1,2-cyclopropanedicarboxylate

C8H12O4 (172.0735552)


   

5-[2-(dimethylamino)ethyl]-1,3,4-thiadiazol-2-amine

5-[2-(dimethylamino)ethyl]-1,3,4-thiadiazol-2-amine

C6H12N4S (172.07826319999998)


   

4-Methoxy-1H-indole-3-carbonitrile

4-Methoxy-1H-indole-3-carbonitrile

C10H8N2O (172.06365979999998)


   

N,N-Dimethylazetidin-3-amine dihydrochloride

N,N-Dimethylazetidin-3-amine dihydrochloride

C5H14Cl2N2 (172.0533984)


   

Methanone,2-furanylphenyl-

Methanone,2-furanylphenyl-

C11H8O2 (172.0524268)


   

3,5-Dimethylphenylhydrazine hydrochloride

3,5-Dimethylphenylhydrazine hydrochloride

C8H13ClN2 (172.0767208)


   
   

6-chloro-4-N-ethylpyrimidine-4,5-diamine

6-chloro-4-N-ethylpyrimidine-4,5-diamine

C6H9ClN4 (172.0515704)


   
   

2-PHENYL-5-VINYL-1,3,4-OXADIAZOLE

2-PHENYL-5-VINYL-1,3,4-OXADIAZOLE

C10H8N2O (172.06365979999998)


   

(S)-PYRROLIDIN-2-YLMETHANAMINE DIHYDROCHLORIDE

(S)-PYRROLIDIN-2-YLMETHANAMINE DIHYDROCHLORIDE

C5H14Cl2N2 (172.0533984)


   

4-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

4-PYRIDINEPROPANAMINE MONOHYDROCHLORIDE

C8H13ClN2 (172.0767208)


   

2-CHLORO-N4,6-DIMETHYLPYRIMIDINE-4,5-DIAMINE

2-CHLORO-N4,6-DIMETHYLPYRIMIDINE-4,5-DIAMINE

C6H9ClN4 (172.0515704)


   

ethyl 3-oxotetrahydro-2H-pyran-4-carboxylate

ethyl 3-oxotetrahydro-2H-pyran-4-carboxylate

C8H12O4 (172.0735552)


   
   

Diethyl fumarate

Diethyl fumarate

C8H12O4 (172.0735552)


A dieter obtained by the formal condensation of fumaric acid with ethanol. Diethyl fumarate is a decomposition product of Malathion (an insecticide). Diethyl fumarate is a reputed skin irritant. Diethyl fumarate can causes non-immunologic contact urticaria on skin[1][2].

   

2-amino-3-(5-oxo-1,2-oxazol-2-yl)propanoic acid

2-amino-3-(5-oxo-1,2-oxazol-2-yl)propanoic acid

C6H8N2O4 (172.0484048)


   

4,7-Dioxooctanoic acid

4,7-Dioxooctanoic acid

C8H12O4 (172.0735552)


A dioxo monocarboxylic acid that is caprylic acid with the two oxo groups at the 4- and 7-positions.

   

Valanimycin

Valanimycin

C7H12N2O3 (172.0847882)


An azoxy compound that is acrylic acid in which the olefinic hydrogen at position 2 has been replaced by an isobutyl-ONN-azoxy group.

   
   

9H-Fluoren-9-yllithium

9H-Fluoren-9-yllithium

C13H9Li (172.0864264)


   

2-Formyloxan-3-yl acetate

2-Formyloxan-3-yl acetate

C8H12O4 (172.0735552)


   

4,7-dihydroxyhexahydro-2-benzofuran-1(3H)-one

4,7-dihydroxyhexahydro-2-benzofuran-1(3H)-one

C8H12O4 (172.0735552)


D009676 - Noxae > D000988 - Antispermatogenic Agents > D013089 - Spermatocidal Agents D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D020011 - Protective Agents > D016588 - Anticarcinogenic Agents D020011 - Protective Agents > D016587 - Antimutagenic Agents D000970 - Antineoplastic Agents

   

5-Hydroxy-4-methoxy-5-(1-methylethyl)-2(5H)-furanone

5-Hydroxy-4-methoxy-5-(1-methylethyl)-2(5H)-furanone

C8H12O4 (172.0735552)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

(S)-2-Amino-3-(3-hydroxy-isoxazol-4-YL)propionic acid

(S)-2-Amino-3-(3-hydroxy-isoxazol-4-YL)propionic acid

C6H8N2O4 (172.0484048)


   

3-Amino-4,5-dihydroxy-cyclohex-1-enecarboxylate

3-Amino-4,5-dihydroxy-cyclohex-1-enecarboxylate

C7H10NO4- (172.06098)


   

2-Naphthoic acid

2-Naphthalenecarboxylic acid

C11H8O2 (172.0524268)


A naphthoic acid that is naphthalene carrying a carboxy group at position 2.

   
   

L-prolinylglycine zwitterion

L-prolinylglycine zwitterion

C7H12N2O3 (172.0847882)


   

2-Acetamido-5-oxopentanoate

2-Acetamido-5-oxopentanoate

C7H10NO4- (172.06098)


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

   

Quinaldate

Quinaldate

C10H6NO2- (172.03985160000002)


A quinolinemonocarboxylate that is the conjugate base of quinaldic acid; major species at pH 7.3.

   

(5S)-5-(carboxymethyl)-L-proline(1-)

(5S)-5-(carboxymethyl)-L-proline(1-)

C7H10NO4- (172.06098)


An alpha-amino-acid anion that is the conjugate base of (2S,5S)-5-carboxymethylproline, obtained by deprotonation of the two carboxy groups and protonation of the endocyclic amino group.

   

beta-(isoxazolin-5-on-4-yl)-L-alanine

beta-(isoxazolin-5-on-4-yl)-L-alanine

C6H8N2O4 (172.0484048)


   

beta-(isoxazolin-5-on-2-yl)-L-alanine

beta-(isoxazolin-5-on-2-yl)-L-alanine

C6H8N2O4 (172.0484048)


   
   

6-Diazo-5-oxonorleucine

6-Diazo-5-oxonorleucine

C6H10N3O3+ (172.072213)


   

(2S,5R)-5-carboxymethyl proline

(2S,5R)-5-carboxymethyl proline

C7H10NO4- (172.06098)


   

(2R,5R)-5-carboxymethyl proline

(2R,5R)-5-carboxymethyl proline

C7H10NO4- (172.06098)


   

(5-Amino-5-carboxy-2-oxopentylidene)-iminoazanium

(5-Amino-5-carboxy-2-oxopentylidene)-iminoazanium

C6H10N3O3+ (172.072213)


   

D1-Piperidine-dicarboxylate

D1-Piperidine-dicarboxylate

C7H10NO4- (172.06098)


   
   

Diethylfumaric acid

Diethylfumaric acid

C8H12O4 (172.0735552)


   

N-formimidoyl-L-glutamate(2-)

N-formimidoyl-L-glutamate(2-)

C6H8N2O4-2 (172.0484048)


   

3-(2-methylpropylthio)-1H-1,2,4-triazol-5-amine

3-(2-methylpropylthio)-1H-1,2,4-triazol-5-amine

C6H12N4S (172.07826319999998)


   
   
   

3-[(E)-prop-1-enyl]pentanedioic acid

3-[(E)-prop-1-enyl]pentanedioic acid

C8H12O4 (172.0735552)


   

(5S)-5-amino-6-hydroxy-2,6-dioxohexane-1-diazonium

(5S)-5-amino-6-hydroxy-2,6-dioxohexane-1-diazonium

C6H10N3O3+ (172.072213)


   

5-Guanidino-2-oxopentanoate

5-Guanidino-2-oxopentanoate

C6H10N3O3- (172.072213)


   

Metronidazole(1+)

Metronidazole(1+)

C6H10N3O3+ (172.072213)


An organic cation resulting from the addition of a proton to metronidazole.

   

Hexahydro[1,2,4]triazino[5,6-E][1,2,4]triazine-3,6(2H,4H)-dione

Hexahydro[1,2,4]triazino[5,6-E][1,2,4]triazine-3,6(2H,4H)-dione

C4H8N6O2 (172.07087080000002)


   

(3-Amino-2,5-dioxopyrrolidin-1-yl)acetic acid

(3-Amino-2,5-dioxopyrrolidin-1-yl)acetic acid

C6H8N2O4 (172.0484048)


   

1,1a,7,7a-Tetrahydro-7a-methyl-7-methylenebenzo[b]cyclopropa[e]pyran

1,1a,7,7a-Tetrahydro-7a-methyl-7-methylenebenzo[b]cyclopropa[e]pyran

C12H12O (172.08881019999998)


   

Hydantoin-5-propionic acid

3-(2,5-Dioxo-imidazolidin-4-yl)-propionic acid

C6H8N2O4 (172.0484048)


A imidazolidine-2,4-dione that is hydantoin substituted by a 2-carboxyethyl group at position 4.

   

Dehydromatricaria ester

Dehydromatricaria ester

C11H8O2 (172.0524268)


   

3-(5-oxoisoxazolin-4-yl)-L-alanine

3-(5-oxoisoxazolin-4-yl)-L-alanine

C6H8N2O4 (172.0484048)


A member of the class of isoxazoles that is L-alanine in which one of the methyl hydrogens is replaced by a 5-oxoisoxazolin-4-yl group.

   

3-(5-oxoisoxazolin-2-yl)-L-alanine

3-(5-oxoisoxazolin-2-yl)-L-alanine

C6H8N2O4 (172.0484048)


A non-proteinogenic L-alpha-amino acid that is L-alanine in which one of the methyl hydrogens is replaced by a 5-oxoisoxazolin-2-yl group.

   

3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion

3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion

C6H8N2O4 (172.0484048)


An amino acid zwitterion resulting from a transfer of a proton from the carboxy group to the amino group of 3-(5-oxoisoxazolin-4-yl)-L-alanine; major species at pH 7.3.

   

3-(5-oxoisoxazolin-2-yl)-L-alanine zwitterion

3-(5-oxoisoxazolin-2-yl)-L-alanine zwitterion

C6H8N2O4 (172.0484048)


An amino acid zwitterion resulting from a transfer of a proton from the carboxy group to the amino group of 3-(5-oxoisoxazolin-2-yl)-L-alanine; major species at pH 7.3.

   

diethylmaleate

diethyl maleate

C8H12O4 (172.0735552)


   

2-Ethoxynaphthalene

β-Naphthol ethyl ether

C12H12O (172.08881019999998)


   

Ethyl 2,4-dioxohexanoate

Ethyl 2,4-dioxohexanoate

C8H12O4 (172.0735552)


   
   
   

trans-3-Octenedioic acid

trans-3-Octenedioic acid

C8H12O4 (172.0735552)


   

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

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

C10H8N2O (172.06365979999998)


   

5-(4-Hydroxybutyl)imidazolidine-2,4-dione

5-(4-Hydroxybutyl)imidazolidine-2,4-dione

C7H12N2O3 (172.0847882)


   

N-formimidoyl-L-glutamate(2-)

N-formimidoyl-L-glutamate(2-)

C6H8N2O4 (172.0484048)


A dicarboxylic acid anion resuting from removal of a proton from both carboxy groups of N-formimidoyl-L-glutamic acid.

   
   

suberate(2-)

suberate(2-)

C8H12O4 (172.0735552)


A dicarboxylic acid dianion obtained by deprotonation of both carboxy groups of suberic acid; major species at pH 7.3.

   

Gly-pro

Gly-pro

C7H12N2O3 (172.0847882)


A dipeptide consisting of L-proline having a glycyl residue attached to its alpha-amino group.

   

Gly-Pro zwitterion

Gly-Pro zwitterion

C7H12N2O3 (172.0847882)


A peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Gly-Pro.

   

Octenedioic acid

Octenedioic acid

C8H12O4 (172.0735552)


   

Dioxooctanoic acid

Dioxooctanoic acid

C8H12O4 (172.0735552)