Exact Mass: 461.12660280000006
Exact Mass Matches: 461.12660280000006
Found 262 metabolites which its exact mass value is equals to given mass value 461.12660280000006
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Morphine-3-glucuronide
Morphine-3-glucuronide belongs to the family of Morphinans. These are polycyclic compounds with a four-ring skeleton with three condensed six-member rings forming a partially hydrogenated phenanthrene moiety, one of which is aromatic while the two others are alicyclic. D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants
Morphine-6-glucuronide
Morphine-6-glucuronide (M6G) is a major active metabolite of morphine, and as such is the molecule responsible for much of the pain-relieving effects of morphine (and thus heroin). M6G is formed from morphine by the enzyme UDP-Glucuronosyltransferase-2B7 (UGT2B7). M6G can accumulate to toxic levels in kidney failure. D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist > C1657 - Opiate
Azlocillin
C20H23N5O6S (461.13689780000004)
Azlocillin is only found in individuals that have used or taken this drug. It is a semisynthetic ampicillin-derived acylureido penicillin.By binding to specific penicillin-binding proteins (PBPs) located inside the bacterial cell wall, azlocillin inhibits the third and last stage of bacterial cell wall synthesis. Cell lysis is then mediated by bacterial cell wall autolytic enzymes such as autolysins; it is possible that azlocillin interferes with an autolysin inhibitor. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CA - Penicillins with extended spectrum D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
SM-17466
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
gammaGluCys(IAN)Gly
C20H23N5O6S (461.13689780000004)
A glutathione conjugate that is the S-cyano(indol-3-yl)methyl derivative of glutathione.
Hydromorphone-3-glucuronide
Hydromorphone-3-glucuronide is a metabolite of hydromorphone. Hydromorphone, a more common synonym for dihydromorphinone, commonly a hydrochloride (brand names Palladone, Dilaudid, and numerous others) is a very potent centrally acting analgesic drug of the opioid class. It is a derivative of morphine, to be specific, a hydrogenated ketone thereof and, therefore, a semi-synthetic drug. It is, in medical terms, an opioid analgesic and, in legal terms, a narcotic. (Wikipedia)
4-(2-Nitroethyl)phenyl primeveroside
4-(2-Nitroethyl)phenyl primeveroside is found in fruits. 4-(2-Nitroethyl)phenyl primeveroside is a constituent of Annona squamosa (sugar apple)
Cyanidin 3-O-(6'-acetyl-arabinoside)
C22H21O11+ (461.10838160000003)
Cyanidin 3-O-(6-acetyl-arabinoside) is a polyphenol compound found in foods of plant origin (PMID: 20428313)
Hydromorphone 3-beta-O-glucuronide
Hydromorphone 3-beta-O-glucuronide is a metabolite of hydromorphone. Hydromorphone, a more common synonym for dihydromorphinone, commonly a hydrochloride (brand names Palladone, Dilaudid, and numerous others) is a very potent centrally acting analgesic drug of the opioid class. It is a derivative of morphine, to be specific, a hydrogenated ketone thereof and, therefore, a semi-synthetic drug. It is, in medical terms, an opioid analgesic and, in legal terms, a narcotic. (Wikipedia)
3-cis-Hydroxyglipizide
C21H27N5O5S (461.1732812000001)
3-cis-Hydroxyglipizide is a metabolite of glipizide. Glipizide is an oral rapid- and short-acting anti-diabetic drug from the sulfonylurea class. It is classified as a second generation sulfonylurea, which means that it undergoes enterohepatic circulation. Second-generation sulfonylureas are both more potent and have shorter half-lives than the first-generation sulfonylureas. Mechanism of action is produced by blocking potassium channels in the beta cells of the islets of Langerhans. (Wikipedia)
4-trans-Hydroxyglipizide
C21H27N5O5S (461.1732812000001)
4-trans-Hydroxyglipizide is a metabolite of glipizide. Glipizide is an oral rapid- and short-acting anti-diabetic drug from the sulfonylurea class. It is classified as a second generation sulfonylurea, which means that it undergoes enterohepatic circulation. Second-generation sulfonylureas are both more potent and have shorter half-lives than the first-generation sulfonylureas. Mechanism of action is produced by blocking potassium channels in the beta cells of the islets of Langerhans. (Wikipedia)
KBT 1585 hydrochloride
C21H23N3O7S (461.12566480000004)
2,5-Dioxopyrrolidin-1-yl 4-(bis(4-chlorophenyl)methyl)piperazine-1-carboxylate
C22H21Cl2N3O4 (461.09090460000004)
Prulifloxacin
C21H20FN3O6S (461.10567920000005)
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01M - Quinolone antibacterials > J01MA - Fluoroquinolones D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
2-[(2-Fluorophenyl)sulfanylmethyl]-5-[6-[(2-hydroxycyclopentyl)amino]purin-9-yl]oxolane-3,4-diol
C21H24FN5O4S (461.15329560000004)
gamma-L-Glutamyl-S-(hercyn-2-yl)-L-cysteine S-oxide
Gln Ala Glu Asp
C17H27N5O10 (461.17578419999995)
2-[7-acetyloxy-5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]propanoic acid
C24H28ClNO6 (461.16050580000007)
4-(2-Nitroethyl)phenyl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside
2-[7-acetyloxy-5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]propanoic acid
C24H28ClNO6 (461.16050580000007)
4-(2-Nitroethyl)phenyl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside_major
4-(2-Nitroethyl)phenyl 6-O-?-D-xylopyranosyl-?-D-glucopyranoside
Ala Asp Glu Gln
C17H27N5O10 (461.17578419999995)
Ala Asp Gln Glu
C17H27N5O10 (461.17578419999995)
Ala Glu Asp Gln
C17H27N5O10 (461.17578419999995)
Ala Glu Glu Asn
C17H27N5O10 (461.17578419999995)
Ala Glu Asn Glu
C17H27N5O10 (461.17578419999995)
Ala Glu Gln Asp
C17H27N5O10 (461.17578419999995)
Ala Asn Glu Glu
C17H27N5O10 (461.17578419999995)
Ala Gln Asp Glu
C17H27N5O10 (461.17578419999995)
Ala Gln Glu Asp
C17H27N5O10 (461.17578419999995)
Cys Asp Pro Gln
Cys Asp Gln Pro
Cys Glu Asn Pro
Cys Glu Pro Asn
Cys Gly Pro Trp
C21H27N5O5S (461.1732812000001)
Cys Gly Trp Pro
C21H27N5O5S (461.1732812000001)
Cys Asn Glu Pro
Cys Asn Pro Glu
Cys Pro Asp Gln
Cys Pro Glu Asn
Cys Pro Gly Trp
C21H27N5O5S (461.1732812000001)
Cys Pro Asn Glu
Cys Pro Gln Asp
Cys Pro Trp Gly
C21H27N5O5S (461.1732812000001)
Cys Gln Asp Pro
Cys Gln Pro Asp
Cys Trp Gly Pro
C21H27N5O5S (461.1732812000001)
Cys Trp Pro Gly
C21H27N5O5S (461.1732812000001)
Asp Ala Glu Gln
C17H27N5O10 (461.17578419999995)
Asp Ala Gln Glu
C17H27N5O10 (461.17578419999995)
Asp Cys Pro Gln
Asp Cys Gln Pro
Asp Asp Asn Val
C17H27N5O10 (461.17578419999995)
Asp Asp Val Asn
C17H27N5O10 (461.17578419999995)
Asp Glu Ala Gln
C17H27N5O10 (461.17578419999995)
Asp Glu Gln Ala
C17H27N5O10 (461.17578419999995)
Asp Asn Asp Val
C17H27N5O10 (461.17578419999995)
Asp Asn Val Asp
C17H27N5O10 (461.17578419999995)
Asp Pro Cys Gln
Asp Pro Gln Cys
Asp Gln Ala Glu
C17H27N5O10 (461.17578419999995)
Asp Gln Cys Pro
Asp Gln Glu Ala
C17H27N5O10 (461.17578419999995)
Asp Gln Pro Cys
Asp Val Asp Asn
C17H27N5O10 (461.17578419999995)
Asp Val Asn Asp
C17H27N5O10 (461.17578419999995)
Glu Ala Asp Gln
C17H27N5O10 (461.17578419999995)
Glu Ala Glu Asn
C17H27N5O10 (461.17578419999995)
Glu Ala Asn Glu
C17H27N5O10 (461.17578419999995)
Glu Ala Gln Asp
C17H27N5O10 (461.17578419999995)
Glu Cys Asn Pro
Glu Cys Pro Asn
Glu Asp Ala Gln
C17H27N5O10 (461.17578419999995)
Glu Asp Gln Ala
C17H27N5O10 (461.17578419999995)
Glu Glu Ala Asn
C17H27N5O10 (461.17578419999995)
Glu Glu Gly Gln
C17H27N5O10 (461.17578419999995)
Glu Glu Asn Ala
C17H27N5O10 (461.17578419999995)
Glu Glu Gln Gly
C17H27N5O10 (461.17578419999995)
Glu Gly Glu Gln
C17H27N5O10 (461.17578419999995)
Glu Gly Gln Glu
C17H27N5O10 (461.17578419999995)
Glu Asn Ala Glu
C17H27N5O10 (461.17578419999995)
Glu Asn Cys Pro
Glu Asn Glu Ala
C17H27N5O10 (461.17578419999995)
Glu Asn Pro Cys
Glu Pro Cys Asn
Glu Pro Asn Cys
Glu Gln Ala Asp
C17H27N5O10 (461.17578419999995)
Glu Gln Asp Ala
C17H27N5O10 (461.17578419999995)
Glu Gln Glu Gly
C17H27N5O10 (461.17578419999995)
Glu Gln Gly Glu
C17H27N5O10 (461.17578419999995)
Gly Cys Pro Trp
C21H27N5O5S (461.1732812000001)
Gly Cys Trp Pro
C21H27N5O5S (461.1732812000001)
Gly Glu Glu Gln
C17H27N5O10 (461.17578419999995)
Gly Glu Gln Glu
C17H27N5O10 (461.17578419999995)
Gly Pro Cys Trp
C21H27N5O5S (461.1732812000001)
Gly Pro Trp Cys
C21H27N5O5S (461.1732812000001)
Gly Gln Glu Glu
C17H27N5O10 (461.17578419999995)
Gly Trp Cys Pro
C21H27N5O5S (461.1732812000001)
Gly Trp Pro Cys
C21H27N5O5S (461.1732812000001)
Asn Ala Glu Glu
C17H27N5O10 (461.17578419999995)
Asn Cys Glu Pro
Asn Cys Pro Glu
Asn Asp Asp Val
C17H27N5O10 (461.17578419999995)
Asn Asp Val Asp
C17H27N5O10 (461.17578419999995)
Asn Glu Ala Glu
C17H27N5O10 (461.17578419999995)
Asn Glu Cys Pro
Asn Glu Glu Ala
C17H27N5O10 (461.17578419999995)
Asn Glu Pro Cys
Asn Pro Cys Glu
Asn Pro Glu Cys
Asn Val Asp Asp
C17H27N5O10 (461.17578419999995)
Pro Cys Asp Gln
Pro Cys Glu Asn
Pro Cys Gly Trp
C21H27N5O5S (461.1732812000001)
Pro Cys Asn Glu
Pro Cys Gln Asp
Pro Cys Trp Gly
C21H27N5O5S (461.1732812000001)
Pro Asp Cys Gln
Pro Asp Gln Cys
Pro Glu Cys Asn
Pro Glu Asn Cys
Pro Gly Cys Trp
C21H27N5O5S (461.1732812000001)
Pro Gly Trp Cys
C21H27N5O5S (461.1732812000001)
Pro Asn Cys Glu
Pro Asn Glu Cys
Pro Gln Cys Asp
Pro Gln Asp Cys
Pro Trp Cys Gly
C21H27N5O5S (461.1732812000001)
Pro Trp Gly Cys
C21H27N5O5S (461.1732812000001)
Gln Ala Asp Glu
C17H27N5O10 (461.17578419999995)
Gln Cys Asp Pro
Gln Cys Pro Asp
Gln Asp Ala Glu
C17H27N5O10 (461.17578419999995)
Gln Asp Cys Pro
Gln Asp Glu Ala
C17H27N5O10 (461.17578419999995)
Gln Asp Pro Cys
Gln Glu Ala Asp
C17H27N5O10 (461.17578419999995)
Gln Glu Asp Ala
C17H27N5O10 (461.17578419999995)
Gln Glu Glu Gly
C17H27N5O10 (461.17578419999995)
Gln Glu Gly Glu
C17H27N5O10 (461.17578419999995)
Gln Gly Glu Glu
C17H27N5O10 (461.17578419999995)
Gln Pro Cys Asp
Gln Pro Asp Cys
Val Asp Asp Asn
C17H27N5O10 (461.17578419999995)
Val Asp Asn Asp
C17H27N5O10 (461.17578419999995)
Val Asn Asp Asp
C17H27N5O10 (461.17578419999995)
Trp Cys Gly Pro
C21H27N5O5S (461.1732812000001)
Trp Cys Pro Gly
C21H27N5O5S (461.1732812000001)
Trp Gly Cys Pro
C21H27N5O5S (461.1732812000001)
Trp Gly Pro Cys
C21H27N5O5S (461.1732812000001)
Trp Pro Cys Gly
C21H27N5O5S (461.1732812000001)
Trp Pro Gly Cys
C21H27N5O5S (461.1732812000001)
Cyanidin 3-O-(6-acetyl-arabinoside)
C22H21O11 (461.10838160000003)
4-(2-Nitroethyl)phenyl primeveroside
2-{7-Acetoxy-5-chloro-3-[(1E,3E)-3,5-dimethyl-1,3-heptadien-1-yl]-7-methyl-6,8-dioxo-7,8-dihydro-2(6H)-isoquinolinyl}propanoic acid
C24H28ClNO6 (461.16050580000007)
lenampicillin
C21H23N3O7S (461.12566480000004)
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
7-Chloro-N-{(3-chlorophenyl)[4-(1-pyrrolidinylmethyl)phenyl]methy l}-4-quinolinamine
Vonoprazan Fumarate
C21H20FN3O6S (461.10567920000005)
C26170 - Protective Agent > C2459 - Chemoprotective Agent > C2080 - Cytoprotective Agent C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent
3-[2-[[4-(diethylamino)phenyl]diazenyl]-6-ethoxy-1,3-benzothiazol-3-ium-3-yl]propanamide,chloride
C22H28ClN5O2S (461.16521380000006)
p-Nitrophenyl phosphate di(tris) salt
C14H28N3O12P (461.14105380000007)
Thieno[2,3-b]quinoline-2-carboxamide, N-[2-(cyclopentylamino)-2-oxoethyl]-N-(2-fluorophenyl)-7-methyl- (9CI)
Thieno[2,3-b]quinoline-2-carboxamide, N-[2-(cyclopentylamino)-2-oxoethyl]-N-(4-fluorophenyl)-6-methyl- (9CI)
3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-5-(4-methylpiperazin-1-yl)sulfonylthiophene-2-carbonitrile
Ethyl 6-[4-(Diphenylamino)phenyl]coumarin-3-carboxylate
C30H23NO4 (461.16269980000004)
SPA-S 510
C24H19N3O5S (461.1045364000001)
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor
N-(3-CHLORO-4-FLUOROPHENYL)-7-(3-MORPHOLINOPROPOXY)-6-NITROQUINAZOLIN-4-AMINE
C21H21ClFN5O4 (461.12660280000006)
1H-Benzimidazole,1-[[4-[(2-ethyl-1-piperidinyl)sulfonyl]phenyl]sulfonyl]-5,6-dimethyl-(9CI)
C22H27N3O4S2 (461.14429020000006)
Prulifloxacin
C21H20FN3O6S (461.10567920000005)
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01M - Quinolone antibacterials > J01MA - Fluoroquinolones D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
N-(Diphenylphosphinyl-α-(p-tosyl)benzyl amine
C26H24NO3PS (461.12144440000003)
9-(4-Dimethylaminophenyl)-2,6,7-trihydroxyfluorone Sulfate
C21H19NO9S (461.07804840000006)
3-Hexyl-1,2-dimethyl-1H-imidazol-3-ium bis[(trifluoromethyl)sulfonyl]azanide
C13H21F6N3O4S2 (461.08776180000007)
MK-5108
C22H21ClFN3O3S (461.0976118000001)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
5-chloro-N-[(5,6-dimethoxypyridin-2-yl)methyl]-2,2:5,3-terpyridine-3-carboxamide
C24H20ClN5O3 (461.1254600000001)
(2r)-2-(5-Chloro-2-Thienyl)-N-{(3s)-1-[(1s)-1-Methyl-2-Morpholin-4-Yl-2-Oxoethyl]-2-Oxopyrrolidin-3-Yl}propene-1-Sulfonamide
C18H24ClN3O5S2 (461.08458440000004)
4-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-3H-benzimidazol-5-yl]oxy]-N-methyl-pyridine-2-carboxamide
C21H15ClF3N5O2 (461.08663160000003)
5-O-(L-Alpha-Aspartylsulfamoyl)adenosine
Asp-AMS, an analogue of aspartyl-adenylate, is an aspartyl-tRNA synthetase inhibitor and also a strong competitive inhibitor of the mitochondrial enzyme. Asp-AMS, an analogue of aspartyl-adenylate, is an aspartyl-tRNA synthetase inhibitor and also a strong competitive inhibitor of the mitochondrial enzyme.
2,5-Dioxopyrrolidin-1-yl 4-(bis(4-chlorophenyl)methyl)piperazine-1-carboxylate
C22H21Cl2N3O4 (461.09090460000004)
Pivcefalexin
C22H27N3O6S (461.1620482000001)
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
[3-(2-Chloro-6-ethoxy-3-quinolinyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone
C25H20ClN3O2S (461.09646900000007)
(1R)-2-[(Cyanomethyl)amino]-1-({[2-(difluoromethoxy)benzyl]sulfonyl}methyl)-2-oxoethyl morpholine-4-carboxylate
1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside 3-phosphate(2-)
Isoscoparin-7-olate
C22H21O11- (461.10838160000003)
The 7-oxoanion of isoscoparin.
alpha-Ketoglutaryl-diaminobutyryl-citryl-ethanolamine
Diaminobutyryl-citryl-ethanolamino-alpha-ketoglutarate
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (2S)-2,4-diamino-4-oxobutanoate
C14H20N7O9P (461.10600800000003)
N-[2-[(6-methoxy-2-methyl-4-quinolinyl)thio]-1-oxoethyl]-2-(1-naphthalenyloxy)acetohydrazide
C25H23N3O4S (461.14091980000006)
3-[[4-(2,6-Difluoro-4-methoxyphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]aniline
3-L-asparaginyl-AMP
C14H20N7O9P (461.10600800000003)
An L-asparaginyl derivative that is the ester obtained by formal condensation of the carboxy group of L-asparagine with the 3-hydroxy group of AMP.
1-[4-Chloro-3-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-(2-methoxyphenyl)urea
C21H20ClN3O5S (461.0812140000001)
4-(1H-benzimidazol-2-ylthio)butanoic acid [2-oxo-2-(4-phenoxyanilino)ethyl] ester
C25H23N3O4S (461.14091980000006)
N-[(4-fluorophenyl)methyl]-2-[3-oxo-6-(1-piperidinylsulfonyl)-1,4-benzoxazin-4-yl]acetamide
C22H24FN3O5S (461.14206260000003)
N-[4-(4-methoxyphenyl)-2-thiazolyl]-2-[(4-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)thio]acetamide
N-(2,5-dimethoxyphenyl)-4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide
C25H23N3O4S (461.14091980000006)
4-methoxy-N-[5-(4-methoxyphenyl)-4-(4-nitrophenyl)-2-thiazolyl]benzamide
C24H19N3O5S (461.1045364000001)
3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide
2-[4-(2-Thiophen-2-ylquinazolin-4-yl)piperazin-1-yl]sulfonylbenzonitrile
Methyl 2-[3-[(7-chloro-4-quinolyl)amino]propylamino]-4-methyl-6-phenyl-pyrimidine-5-carboxylate
2-O-acetylcrinamabine Trifluoroacetic acid
A natural product found in Crinum asiaticum var. sinicum.
2-methylthio-N(6)-dimethylallyladenine 5-monophosphate
C16H24N5O7PS (461.11340040000005)
18-(2,3-Dimethoxyphenyl)-15-phenyl-11-oxa-13,15-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2,4,6,8,12(17),13-heptaen-16-imine
(1S,9R,10R,11R)-10-(hydroxymethyl)-N-(2-methoxyethyl)-12-(2-methylphenyl)sulfonyl-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
C22H27N3O6S (461.1620482000001)
2-[(2S,3R,6R)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
2-[(2R,3R,6S)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
2-[(2R,3S,6S)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
2-[(2R,3S,6R)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
2-[(2R,3R,6R)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
(1R,9S,10S,11S)-10-(hydroxymethyl)-N-(2-methoxyethyl)-12-(2-methylphenyl)sulfonyl-6-oxo-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
C22H27N3O6S (461.1620482000001)
2-[(2S,3R,6S)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
2-[(2S,3S,6R)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
2-[(2S,3S,6S)-2-(hydroxymethyl)-3-[(4-methoxyphenyl)sulfonylamino]-3,6-dihydro-2H-pyran-6-yl]-N-(2-pyridin-4-ylethyl)acetamide
C22H27N3O6S (461.1620482000001)
5-O-{[3-(benzoyloxy)-3-oxopropyl]carbamoyl}thymidine
C21H23N3O9 (461.14342280000005)
N(alpha)-(L-gamma-glutamyl)-hercynyl-L-cysteine sulfoxide
A non-proteinogenic dipeptide formed from L-gamma-glutamic acid and hercynyl-L-cysteine sulfoxide residues. It is an intermediate in the synthesis of ergothioneine, a compound found in certain fungi and mycobacteria.
(2S,5S,6R)-3,3-dimethyl-7-oxo-6-[[(2R)-1-oxo-2-[[oxo-(2-oxo-1-imidazolidinyl)methyl]amino]-2-phenylethyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
C20H23N5O6S (461.13689780000004)
4-methoxyphenyl 3-O-(beta-D-glucopyranosyluronate)-beta-D-galactopyranoside
(2S,3S,4S,5R)-6-[3-acetamido-2-hydroxy-5-(4-methylbenzoyl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Azlocillin
C20H23N5O6S (461.13689780000004)
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CA - Penicillins with extended spectrum A semisynthetic penicillin antibiotic used in treating infections caused by Pseudomonas aeruginosa, Escherichia coli, and Haemophilus influenzae. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
Morphine-6-glucuronide
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist > C1657 - Opiate
m-3-g hydrate
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants
Cyanidin 3-O-(6-acetyl-arabinoside)
C22H21O11+ (461.10838160000003)
B-Raf IN 2
C20H17F2N5O4S (461.0969266000001)
B-Raf IN 2 is a potent and selective BRAF inhibitor extracted from patent WO2021116055A1, compound Ia. B-Raf IN 2 can be used for the research of cancer[1].
FAUC 365
FAUC 365 is a highly dopamine D3 receptor-selective antagonist with Ki values of 0.5 nM, 340, 2600, and 3600 nM at D3, D4.4, D2short, and D2Long receptors, respectively. FAUC 365 can be used for the research of schizophrenia, and Parkinson's disease[1][2].
(2s,5r,6r)-6-{[(2r)-1-hydroxy-2-{[hydroxy(2-hydroxy-4,5-dihydroimidazol-1-yl)methylidene]amino}-2-phenylethylidene]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
C20H23N5O6S (461.13689780000004)
(2s,3r,4s,5s,6r)-2-[4-(2-nitroethyl)phenoxy]-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
bis(4-hydroxy-3-(hydroxyimino)cyclohexa-1,5-diene-1-carbaldehyde); 6-(hydroxyimino)-4-(hydroxymethyl)cyclohexa-2,4-dien-1-ol
C21H23N3O9 (461.14342280000005)
1-(3,4-dihydroxyphenyl)-3-[2-(3,4-dihydroxyphenyl)ethyl]-7,8-dihydroxychromeno[3,4-b]pyrrol-4-one
C25H19NO8 (461.11106140000004)
6'-o-α-l-arabinofuranosylthalictoside
{"Ingredient_id": "HBIN012630","Ingredient_name": "6'-o-\u03b1-l-arabinofuranosylthalictoside","Alias": "NA","Ingredient_formula": "C19H27NO12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1558","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6'-o-β-d-apiofuranosylthalictoside
{"Ingredient_id": "HBIN012638","Ingredient_name": "6'-o-\u03b2-d-apiofuranosylthalictoside","Alias": "NA","Ingredient_formula": "C19H27NO12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1518","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}