Exact Mass: 177.9702
Exact Mass Matches: 177.9702
Found 262 metabolites which its exact mass value is equals to given mass value 177.9702,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Pyrophosphate
The anion, the salts, and the esters of pyrophosphoric acid are called pyrophosphates. The pyrophosphate anion is abbreviated PPi and is formed by the hydrolysis of ATP into AMP in cells. This hydrolysis is called pyrophosphorolysis. The pyrophosphate anion has the structure P2O74-, and is an acid anhydride of phosphate. It is unstable in aqueous solution and rapidly hydrolyzes into inorganic phosphate. Pyrophosphate is an osteotoxin (arrests bone development) and an arthritogen (promotes arthritis). It is also a metabotoxin (an endogenously produced metabolite that causes adverse health affects at chronically high levels). Chronically high levels of pyrophosphate are associated with hypophosphatasia. Hypophosphatasia (also called deficiency of alkaline phosphatase or phosphoethanolaminuria) is a rare, and sometimes fatal, metabolic bone disease. Hypophosphatasia is associated with a molecular defect in the gene encoding tissue non-specific alkaline phosphatase (TNSALP). TNSALP is an enzyme that is tethered to the outer surface of osteoblasts and chondrocytes. TNSALP hydrolyzes several substances, including inorganic pyrophosphate (PPi) and pyridoxal 5-phosphate (PLP), a major form of vitamin B6. When TSNALP is low, inorganic pyrophosphate (PPi) accumulates outside of cells and inhibits the formation of hydroxyapatite, one of the main components of bone, causing rickets in infants and children and osteomalacia (soft bones) in adults. Vitamin B6 must be dephosphorylated by TNSALP before it can cross the cell membrane. Vitamin B6 deficiency in the brain impairs synthesis of neurotransmitters which can cause seizures. In some cases, a build-up of calcium pyrophosphate dihydrate crystals in the joints can cause pseudogout. COVID info from WikiPathways Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
2,5-dichlorohydroquinone
A dichlorohydroquinone that is hydroquinone substituted by chloro groups at positions 2 and 5 respectively.
3,6-dichlorocatechol
3,6-dichlorocatechol, also known as 3,6-dichloro-1,2-benzenediol, is a member of the class of compounds known as 3-chlorocatechols. 3-chlorocatechols are chlorocatechols with the chlorine atom attached at position C3 of the benzene ring. 3,6-dichlorocatechol is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 3,6-dichlorocatechol can be found in a number of food items such as gooseberry, jicama, nutmeg, and lingonberry, which makes 3,6-dichlorocatechol a potential biomarker for the consumption of these food products.
Arsenobetaine
Arsenobetaine is found in crustaceans. Arsenobetaine is found in algae, lobsters, sharks, etc. Arsenobetaine is an organoarsenic compound that is the main source of arsenic found in fish. It is the arsenic analogue of trimethylglycine, commonly known as betaine. The biochemistry and its biosynthesis are similar to the biosynthesis of choline and betaine. The; Besides several other arsenic compounds, such as dimethylarsine and trimethylarsine, arsenobetaine is a common substance in the marine biological systems for arsenic detoxification. Found in algae, lobsters, sharks, etc.
Allitridin
Volatile component from onion (Allium sativum), garlic (Allium sativum) and other commercial garlics. Potential nutriceutical. Allitridin is found in many foods, some of which are onion-family vegetables, garden onion, soft-necked garlic, and garlic. Allitridin is found in garden onion. Allitridin is a volatile component from onion (Allium sativum), garlic (Allium sativum) and other commercial garlics. Potential nutriceutica D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D009676 - Noxae > D000988 - Antispermatogenic Agents > D013089 - Spermatocidal Agents D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D020011 - Protective Agents > D000975 - Antioxidants D010575 - Pesticides > D007306 - Insecticides D009676 - Noxae > D000963 - Antimetabolites D016573 - Agrochemicals Diallyl Trisulfide is isolated from Garlic. Diallyl Trisulfide suppresses the growth of Penicillium expansum (MFC99 value: ≤ 90 μg/mL) and promotes apoptosis via production of reactive oxygen species (ROS) and disintegration of cellular ultrastructure. Anticancer effect[1]. Diallyl Trisulfide is isolated from Garlic. Diallyl Trisulfide suppresses the growth of Penicillium expansum (MFC99 value: ≤ 90 μg/mL) and promotes apoptosis via production of reactive oxygen species (ROS) and disintegration of cellular ultrastructure. Anticancer effect[1].
Bissulfine
Constituent of onion (Allium cepa). Bissulfine is found in garden onion and onion-family vegetables. Bissulfine is found in onion-family vegetables. Bissulfine is a constituent of onion (Allium cepa)
S-2-Propenyl 2-propene-1-sulfonothioate
S-2-Propenyl 2-propene-1-sulfonothioate is found in onion-family vegetables. S-2-Propenyl 2-propene-1-sulfonothioate is a constituent of garlic (Allium sativum). Constituent of garlic (Allium sativum). S-2-Propenyl 2-propene-1-sulfonothioate is found in garlic and onion-family vegetables.
S,S'-Ethylidene dithioacetate
S,S-Ethylidene dithioacetate is found in citrus. S,S-Ethylidene dithioacetate is isolated from orange juice. Isolated from orange juice. S,S-Ethylidene dithioacetate is found in citrus.
Allyl-1-propenyl trisulfide
Trans-1-propenyl allyl trisulfide is a member of the class of compounds known as organic trisulfides. Organic trisulfides are organosulfur compounds with the general formula RSSSR (R,R=alkyl, aryl). Trans-1-propenyl allyl trisulfide can be found in soft-necked garlic, which makes trans-1-propenyl allyl trisulfide a potential biomarker for the consumption of this food product.
Di-1-propenyl trisulfide
Di-1-propenyl trisulfide is a member of the class of compounds known as organic trisulfides. Organic trisulfides are organosulfur compounds with the general formula RSSSR (R,R=alkyl, aryl). Di-1-propenyl trisulfide can be found in soft-necked garlic, which makes di-1-propenyl trisulfide a potential biomarker for the consumption of this food product.
Hexa-1,5-dienyl trisulfide
Hexa-1,5-dienyl trisulfide is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Hexa-1,5-dienyl trisulfide can be found in soft-necked garlic, which makes hexa-1,5-dienyl trisulfide a potential biomarker for the consumption of this food product.
alpha-Amino-3-chloro-4,5-dihydro-5-isoxazoleacetic acid
Diallyl Trisulfide
Diallyl Trisulfide is isolated from Garlic. Diallyl Trisulfide suppresses the growth of Penicillium expansum (MFC99 value: ≤ 90 μg/mL) and promotes apoptosis via production of reactive oxygen species (ROS) and disintegration of cellular ultrastructure. Anticancer effect[1]. Diallyl Trisulfide is isolated from Garlic. Diallyl Trisulfide suppresses the growth of Penicillium expansum (MFC99 value: ≤ 90 μg/mL) and promotes apoptosis via production of reactive oxygen species (ROS) and disintegration of cellular ultrastructure. Anticancer effect[1].
Acivicin
An L-alpha-amino acid that is L-alanine in which the methyl group is replaced by a (5S)-3-chloro-4,5-dihydro-1,2-oxazol-5-yl group. A glutamine analogue antimetabolite, it interferes with glutamate metabolism and several glutamate-dependent synthetic enzymes. It is obtained as a fermentation product of Streptomyces sviceus bacteria. C471 - Enzyme Inhibitor > C2158 - Glutamine Amidotransferase Inhibitor D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors
Imidazo[1,2-b]pyridazine-3-carbonitrile, 6-chloro-
Disodium phosphate dihydrate
C78275 - Agent Affecting Blood or Body Fluid > C29730 - Electrolyte Replacement Agent
(3-BOC-AMINO-PYRROLIDIN-1-YL)-PYRIDIN-3-YL-ACETICACID
2-Methyl-1-oxo-1-phenylpropan-2-yl methanesulfonate
4-Chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
5-methylsulfanyl-1,3,4-oxadiazole-2-carbonyl chloride
2-PYRIDINAMINE, 4-CHLORO-N-METHYL-, MONOHYDROCHLORIDE
Sodium Orotate
An organic sodium salt comprising equal numbers of sodium and orotate ions.
2-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
5-Isoxazoleacetic acid, alpha-amino-3-chloro-4,5-dihydro-
D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D009676 - Noxae > D000963 - Antimetabolites D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors
3,4-Dichlorocatechol
A dichlorocatechol that is catechol in which the hydrogens at positions 3 and 4 are replaced by chlorines.
Garlic oil
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D009676 - Noxae > D000988 - Antispermatogenic Agents > D013089 - Spermatocidal Agents D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D020011 - Protective Agents > D000975 - Antioxidants D010575 - Pesticides > D007306 - Insecticides D009676 - Noxae > D000963 - Antimetabolites D016573 - Agrochemicals Diallyl Trisulfide is isolated from Garlic. Diallyl Trisulfide suppresses the growth of Penicillium expansum (MFC99 value: ≤ 90 μg/mL) and promotes apoptosis via production of reactive oxygen species (ROS) and disintegration of cellular ultrastructure. Anticancer effect[1]. Diallyl Trisulfide is isolated from Garlic. Diallyl Trisulfide suppresses the growth of Penicillium expansum (MFC99 value: ≤ 90 μg/mL) and promotes apoptosis via production of reactive oxygen species (ROS) and disintegration of cellular ultrastructure. Anticancer effect[1].
6-Hydroxy-2,3-dihydro-1,3-benzothiazole-2-carbonitrile
2-Azaniumyl-2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)acetate
S-carboxylatomethyl-L-cysteine(1-)
The conjugate base of S-carboxymethyl-L-cysteine having anionic carboxy groups and a protonated amino group; major species at pH 7.3.
3-Methylthioaspartate(1-)
An alpha-amino-acid anion obtained by deprotonation of the two carboxy groups and protonation of the amino group of 3-methylthioaspartic acid.
Diphosphoric acid
An acyclic phosphorus acid anhydride obtained by condensation of two molecules of phosphoric acid. COVID info from WikiPathways Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3,6-dichloropyridine-2,5-diol(1-)
A organic anion that is the conjugate base of 3,6-dichloropyridine-2,5-diol, resulting from the deprotonation of the 5-hydroxy group.
1-propenylallylthiosulfinate
{"Ingredient_id": "HBIN003001","Ingredient_name": "1-propenylallylthiosulfinate","Alias": "NA","Ingredient_formula": "C6H10O2S2","Ingredient_Smile": "CC=COS(=O)SCC=C","Ingredient_weight": "178.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT17324","TCMID_id": "17905","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "129704166","DrugBank_id": "NA"}
