Exact Mass: 463.12517920000005
Exact Mass Matches: 463.12517920000005
Found 453 metabolites which its exact mass value is equals to given mass value 463.12517920000005
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
7-Methylthioheptyl glucosinolate
C15H29NO9S3 (463.10043840000003)
Acquisition and generation of the data is financially supported by the Max-Planck-Society
Peonidin-3-glucoside
Peonidin-3-glucoside has been proposed by Wu et al. [PMID: 12097661] to be a secondary metabolite of cyanidin-3-glucoside which may be methylated by liver enzymes during phase II metabolism. Peonidin 3-glucoside is isolated from grapes and many other plant spp. It is found in red wine, common wheat, and lowbush blueberry. Acquisition and generation of the data is financially supported in part by CREST/JST.
1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside 3-phosphate
L 735821
D002317 - Cardiovascular Agents > D026902 - Potassium Channel Blockers D049990 - Membrane Transport Modulators
Pinotin A aglycone
Pinotin A aglycone is a polyphenol compound found in foods of plant origin (PMID: 20428313)
Isopeonidin 3-galactoside
Isopeonidin 3-galactoside is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
Isopeonidin 3-glucoside
Isopeonidin 3-glucoside is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
Rosuvastatin 5 S-lactone
C22H26FN3O5S (463.1577118000001)
Rosuvastatin 5 S-lactone is a metabolite of rosuvastatin. Rosuvastatin (marketed by AstraZeneca as Crestor) is a member of the drug class of statins, used to treat high cholesterol and related conditions, and to prevent cardiovascular disease. It was developed by Shionogi. (Wikipedia)
ent-Rosuvastatin Lactone
C22H26FN3O5S (463.1577118000001)
Glutamate nitrogen
C15H21N5O12 (463.11866660000004)
Sipoglitazar
C25H25N3O4S (463.15656900000005)
C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C154291 - Peroxisome Proliferator-Activated Receptor Agonist
N-Carbobenzoxyglycyl-prolyl-4-methylcoumarinyl amide
Malvidin 3-arabinoside
Malvidin 3-arabinoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Malvidin 3-arabinoside can be found in a number of food items such as sweet cherry, lingonberry, red raspberry, and american cranberry, which makes malvidin 3-arabinoside a potential biomarker for the consumption of these food products.
Peonidin 3-galactoside
Peonidin 3-galactoside is a member of the class of compounds known as anthocyanidin-3-o-glycosides. Anthocyanidin-3-o-glycosides are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C3-position. Peonidin 3-galactoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Peonidin 3-galactoside can be found in a number of food items such as mango, red raspberry, rubus (blackberry, raspberry), and bilberry, which makes peonidin 3-galactoside a potential biomarker for the consumption of these food products.
7-methylthioheptyl glucosinolate
C15H29NO9S3 (463.10043840000003)
7-methylthioheptyl glucosinolate is a member of the class of compounds known as alkylglucosinolates. Alkylglucosinolates are organic compounds containing a glucosinolate moiety that carries an alkyl chain. 7-methylthioheptyl glucosinolate is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). 7-methylthioheptyl glucosinolate can be found in a number of food items such as macadamia nut (m. tetraphylla), annual wild rice, herbs and spices, and horseradish tree, which makes 7-methylthioheptyl glucosinolate a potential biomarker for the consumption of these food products.
Peonidin galactoside
Malvidin 3-arabinoside
Glucopeonidin
O1-Benzoyl-2-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridyl]methoxy}phenyl)ethanehydroximamide
C22H17ClF3N3O3 (463.09104780000007)
(S)-Phenyl-(tetra-O-acetyl-beta-D-glucopyranosyloxy)-acetonitril|(S)-phenyl-(tetra-O-acetyl-beta-D-glucopyranosyloxy)-acetonitrile|sambunigrin tetraacetate
Thr Asp Asn Asp
C16H25N5O11 (463.15504999999996)
Peonidin-3-O-beta-galactopyranoside
Acquisition and generation of the data is financially supported in part by CREST/JST.
(Methylsulfanyl)heptyl glucosinolate
C15H29NO9S3 (463.10043840000003)
Annotation level-3
AVE3295
C25H22FN3O3S (463.13658340000006)
CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4217; ORIGINAL_PRECURSOR_SCAN_NO 4215 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4235; ORIGINAL_PRECURSOR_SCAN_NO 4234 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4218; ORIGINAL_PRECURSOR_SCAN_NO 4217 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4228; ORIGINAL_PRECURSOR_SCAN_NO 4226 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4237; ORIGINAL_PRECURSOR_SCAN_NO 4236 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4231; ORIGINAL_PRECURSOR_SCAN_NO 4229 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9056; ORIGINAL_PRECURSOR_SCAN_NO 9054 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9059; ORIGINAL_PRECURSOR_SCAN_NO 9057 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9067; ORIGINAL_PRECURSOR_SCAN_NO 9066 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9069; ORIGINAL_PRECURSOR_SCAN_NO 9067 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9087; ORIGINAL_PRECURSOR_SCAN_NO 9082 CONFIDENCE standard compound; INTERNAL_ID 1003; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9081; ORIGINAL_PRECURSOR_SCAN_NO 9077
8-2-Amino-3-methylimidazo[4,5-f]quinoline-deoxyguanosine
C21H21N9O4 (463.17164260000004)
Ala Asp Met Gln
C17H29N5O8S (463.17367540000004)
Ala Asp Gln Met
C17H29N5O8S (463.17367540000004)
Ala Glu Met Asn
C17H29N5O8S (463.17367540000004)
Ala Glu Asn Met
C17H29N5O8S (463.17367540000004)
Ala Met Asp Gln
C17H29N5O8S (463.17367540000004)
Ala Met Glu Asn
C17H29N5O8S (463.17367540000004)
Ala Met Asn Glu
C17H29N5O8S (463.17367540000004)
Ala Met Gln Asp
C17H29N5O8S (463.17367540000004)
Ala Asn Glu Met
C17H29N5O8S (463.17367540000004)
Ala Asn Met Glu
C17H29N5O8S (463.17367540000004)
Ala Gln Asp Met
C17H29N5O8S (463.17367540000004)
Ala Gln Met Asp
C17H29N5O8S (463.17367540000004)
Cys Asp Ile Asn
C17H29N5O8S (463.17367540000004)
Cys Asp Leu Asn
C17H29N5O8S (463.17367540000004)
Cys Asp Asn Ile
C17H29N5O8S (463.17367540000004)
Cys Asp Asn Leu
C17H29N5O8S (463.17367540000004)
Cys Asp Gln Val
C17H29N5O8S (463.17367540000004)
Cys Asp Val Gln
C17H29N5O8S (463.17367540000004)
Cys Glu Asn Val
C17H29N5O8S (463.17367540000004)
Cys Glu Val Asn
C17H29N5O8S (463.17367540000004)
Cys Ile Asp Asn
C17H29N5O8S (463.17367540000004)
Cys Ile Asn Asp
C17H29N5O8S (463.17367540000004)
Cys Leu Asp Asn
C17H29N5O8S (463.17367540000004)
Cys Leu Asn Asp
C17H29N5O8S (463.17367540000004)
Cys Met Asn Pro
Cys Met Pro Asn
Cys Asn Asp Ile
C17H29N5O8S (463.17367540000004)
Cys Asn Asp Leu
C17H29N5O8S (463.17367540000004)
Cys Asn Glu Val
C17H29N5O8S (463.17367540000004)
Cys Asn Ile Asp
C17H29N5O8S (463.17367540000004)
Cys Asn Leu Asp
C17H29N5O8S (463.17367540000004)
Cys Asn Met Pro
Cys Asn Asn Asn
Cys Asn Pro Met
Cys Asn Val Glu
C17H29N5O8S (463.17367540000004)
Cys Pro Met Asn
Cys Pro Asn Met
Cys Gln Asp Val
C17H29N5O8S (463.17367540000004)
Cys Gln Val Asp
C17H29N5O8S (463.17367540000004)
Cys Val Asp Gln
C17H29N5O8S (463.17367540000004)
Cys Val Glu Asn
C17H29N5O8S (463.17367540000004)
Cys Val Asn Glu
C17H29N5O8S (463.17367540000004)
Cys Val Gln Asp
C17H29N5O8S (463.17367540000004)
Asp Ala Met Gln
C17H29N5O8S (463.17367540000004)
Asp Ala Gln Met
C17H29N5O8S (463.17367540000004)
Asp Cys Ile Asn
C17H29N5O8S (463.17367540000004)
Asp Cys Leu Asn
C17H29N5O8S (463.17367540000004)
Asp Cys Asn Ile
C17H29N5O8S (463.17367540000004)
Asp Cys Asn Leu
C17H29N5O8S (463.17367540000004)
Asp Cys Gln Val
C17H29N5O8S (463.17367540000004)
Asp Cys Val Gln
C17H29N5O8S (463.17367540000004)
Asp Asp Asn Thr
C16H25N5O11 (463.15504999999996)
Asp Asp Gln Ser
C16H25N5O11 (463.15504999999996)
Asp Asp Ser Gln
C16H25N5O11 (463.15504999999996)
Asp Asp Thr Asn
C16H25N5O11 (463.15504999999996)
Asp Glu Asn Ser
C16H25N5O11 (463.15504999999996)
Asp Glu Ser Asn
C16H25N5O11 (463.15504999999996)
Asp Gly Ser Trp
Asp Gly Trp Ser
Asp Ile Cys Asn
C17H29N5O8S (463.17367540000004)
Asp Ile Asn Cys
C17H29N5O8S (463.17367540000004)
Asp Leu Cys Asn
C17H29N5O8S (463.17367540000004)
Asp Leu Asn Cys
C17H29N5O8S (463.17367540000004)
Asp Met Ala Gln
C17H29N5O8S (463.17367540000004)
Asp Met Gln Ala
C17H29N5O8S (463.17367540000004)
Asp Asn Cys Ile
C17H29N5O8S (463.17367540000004)
Asp Asn Cys Leu
C17H29N5O8S (463.17367540000004)
Asp Asn Asp Thr
C16H25N5O11 (463.15504999999996)
Asp Asn Glu Ser
C16H25N5O11 (463.15504999999996)
Asp Asn Ile Cys
C17H29N5O8S (463.17367540000004)
Asp Asn Leu Cys
C17H29N5O8S (463.17367540000004)
Asp Asn Ser Glu
C16H25N5O11 (463.15504999999996)
Asp Asn Thr Asp
C16H25N5O11 (463.15504999999996)
Asp Gln Ala Met
C17H29N5O8S (463.17367540000004)
Asp Gln Cys Val
C17H29N5O8S (463.17367540000004)
Asp Gln Asp Ser
C16H25N5O11 (463.15504999999996)
Asp Gln Met Ala
C17H29N5O8S (463.17367540000004)
Asp Gln Ser Asp
C16H25N5O11 (463.15504999999996)
Asp Gln Val Cys
C17H29N5O8S (463.17367540000004)
Asp Ser Asp Gln
C16H25N5O11 (463.15504999999996)
Asp Ser Glu Asn
C16H25N5O11 (463.15504999999996)
Asp Ser Gly Trp
Asp Ser Asn Glu
C16H25N5O11 (463.15504999999996)
Asp Ser Gln Asp
C16H25N5O11 (463.15504999999996)
Asp Ser Trp Gly
Asp Thr Asp Asn
C16H25N5O11 (463.15504999999996)
Asp Thr Asn Asp
C16H25N5O11 (463.15504999999996)
Asp Val Cys Gln
C17H29N5O8S (463.17367540000004)
Asp Val Gln Cys
C17H29N5O8S (463.17367540000004)
Asp Trp Gly Ser
Asp Trp Ser Gly
Glu Ala Met Asn
C17H29N5O8S (463.17367540000004)
Glu Ala Asn Met
C17H29N5O8S (463.17367540000004)
Glu Cys Asn Val
C17H29N5O8S (463.17367540000004)
Glu Cys Val Asn
C17H29N5O8S (463.17367540000004)
Glu Asp Asn Ser
C16H25N5O11 (463.15504999999996)
Glu Asp Ser Asn
C16H25N5O11 (463.15504999999996)
Glu Gly Met Gln
C17H29N5O8S (463.17367540000004)
Glu Gly Gln Met
C17H29N5O8S (463.17367540000004)
Glu Met Ala Asn
C17H29N5O8S (463.17367540000004)
Glu Met Gly Gln
C17H29N5O8S (463.17367540000004)
Glu Met Asn Ala
C17H29N5O8S (463.17367540000004)
Glu Met Gln Gly
C17H29N5O8S (463.17367540000004)
Glu Asn Ala Met
C17H29N5O8S (463.17367540000004)
Glu Asn Cys Val
C17H29N5O8S (463.17367540000004)
Glu Asn Asp Ser
C16H25N5O11 (463.15504999999996)
Glu Asn Met Ala
C17H29N5O8S (463.17367540000004)
Glu Asn Ser Asp
C16H25N5O11 (463.15504999999996)
Glu Asn Val Cys
C17H29N5O8S (463.17367540000004)
Glu Gln Gly Met
C17H29N5O8S (463.17367540000004)
Glu Gln Met Gly
C17H29N5O8S (463.17367540000004)
Glu Ser Asp Asn
C16H25N5O11 (463.15504999999996)
Glu Ser Asn Asp
C16H25N5O11 (463.15504999999996)
Glu Val Cys Asn
C17H29N5O8S (463.17367540000004)
Glu Val Asn Cys
C17H29N5O8S (463.17367540000004)
Gly Asp Ser Trp
Gly Asp Trp Ser
Gly Glu Met Gln
C17H29N5O8S (463.17367540000004)
Gly Glu Gln Met
C17H29N5O8S (463.17367540000004)
Gly Met Glu Gln
C17H29N5O8S (463.17367540000004)
Gly Met Gln Glu
C17H29N5O8S (463.17367540000004)
Gly Gln Glu Met
C17H29N5O8S (463.17367540000004)
Gly Gln Met Glu
C17H29N5O8S (463.17367540000004)
Gly Ser Asp Trp
Gly Ser Trp Asp
Gly Trp Asp Ser
Gly Trp Ser Asp
Ile Cys Asp Asn
C17H29N5O8S (463.17367540000004)
Ile Cys Asn Asp
C17H29N5O8S (463.17367540000004)
Ile Asp Cys Asn
C17H29N5O8S (463.17367540000004)
Ile Asp Asn Cys
C17H29N5O8S (463.17367540000004)
Ile Asn Cys Asp
C17H29N5O8S (463.17367540000004)
Ile Asn Asp Cys
C17H29N5O8S (463.17367540000004)
Leu Cys Asp Asn
C17H29N5O8S (463.17367540000004)
Leu Cys Asn Asp
C17H29N5O8S (463.17367540000004)
Leu Asp Cys Asn
C17H29N5O8S (463.17367540000004)
Leu Asp Asn Cys
C17H29N5O8S (463.17367540000004)
Leu Asn Cys Asp
C17H29N5O8S (463.17367540000004)
Leu Asn Asp Cys
C17H29N5O8S (463.17367540000004)
Met Ala Asp Gln
C17H29N5O8S (463.17367540000004)
Met Ala Glu Asn
C17H29N5O8S (463.17367540000004)
Met Ala Asn Glu
C17H29N5O8S (463.17367540000004)
Met Ala Gln Asp
C17H29N5O8S (463.17367540000004)
Met Cys Asn Pro
Met Cys Pro Asn
Met Asp Ala Gln
C17H29N5O8S (463.17367540000004)
Met Asp Gln Ala
C17H29N5O8S (463.17367540000004)
Met Glu Ala Asn
C17H29N5O8S (463.17367540000004)
Met Glu Gly Gln
C17H29N5O8S (463.17367540000004)
Met Glu Asn Ala
C17H29N5O8S (463.17367540000004)
Met Glu Gln Gly
C17H29N5O8S (463.17367540000004)
Met Gly Glu Gln
C17H29N5O8S (463.17367540000004)
Met Gly Gln Glu
C17H29N5O8S (463.17367540000004)
Met Asn Ala Glu
C17H29N5O8S (463.17367540000004)
Met Asn Cys Pro
Met Asn Glu Ala
C17H29N5O8S (463.17367540000004)
Met Asn Pro Cys
Met Pro Cys Asn
Met Pro Asn Cys
Met Gln Ala Asp
C17H29N5O8S (463.17367540000004)
Met Gln Asp Ala
C17H29N5O8S (463.17367540000004)
Met Gln Glu Gly
C17H29N5O8S (463.17367540000004)
Met Gln Gly Glu
C17H29N5O8S (463.17367540000004)
Asn Ala Glu Met
C17H29N5O8S (463.17367540000004)
Asn Ala Met Glu
C17H29N5O8S (463.17367540000004)
Asn Cys Asp Ile
C17H29N5O8S (463.17367540000004)
Asn Cys Asp Leu
C17H29N5O8S (463.17367540000004)
Asn Cys Glu Val
C17H29N5O8S (463.17367540000004)
Asn Cys Ile Asp
C17H29N5O8S (463.17367540000004)
Asn Cys Leu Asp
C17H29N5O8S (463.17367540000004)
Asn Cys Met Pro
Asn Cys Asn Asn
Asn Cys Pro Met
Asn Cys Val Glu
C17H29N5O8S (463.17367540000004)
Asn Asp Cys Ile
C17H29N5O8S (463.17367540000004)
Asn Asp Cys Leu
C17H29N5O8S (463.17367540000004)
Asn Asp Asp Thr
C16H25N5O11 (463.15504999999996)
Asn Asp Glu Ser
C16H25N5O11 (463.15504999999996)
Asn Asp Ile Cys
C17H29N5O8S (463.17367540000004)
Asn Asp Leu Cys
C17H29N5O8S (463.17367540000004)
Asn Asp Ser Glu
C16H25N5O11 (463.15504999999996)
Asn Asp Thr Asp
C16H25N5O11 (463.15504999999996)
Asn Glu Ala Met
C17H29N5O8S (463.17367540000004)
Asn Glu Cys Val
C17H29N5O8S (463.17367540000004)
Asn Glu Asp Ser
C16H25N5O11 (463.15504999999996)
Asn Glu Met Ala
C17H29N5O8S (463.17367540000004)
Asn Glu Ser Asp
C16H25N5O11 (463.15504999999996)
Asn Glu Val Cys
C17H29N5O8S (463.17367540000004)
Asn Ile Cys Asp
C17H29N5O8S (463.17367540000004)
Asn Ile Asp Cys
C17H29N5O8S (463.17367540000004)
Asn Leu Cys Asp
C17H29N5O8S (463.17367540000004)
Asn Leu Asp Cys
C17H29N5O8S (463.17367540000004)
Asn Met Ala Glu
C17H29N5O8S (463.17367540000004)
Asn Met Cys Pro
Asn Met Glu Ala
C17H29N5O8S (463.17367540000004)
Asn Met Pro Cys
Asn Asn Cys Asn
Asn Asn Asn Cys
Asn Pro Cys Met
Asn Pro Met Cys
Asn Ser Asp Glu
C16H25N5O11 (463.15504999999996)
Asn Ser Glu Asp
C16H25N5O11 (463.15504999999996)
Asn Thr Asp Asp
C16H25N5O11 (463.15504999999996)
Asn Val Cys Glu
C17H29N5O8S (463.17367540000004)
Asn Val Glu Cys
C17H29N5O8S (463.17367540000004)
Pro Cys Met Asn
Pro Cys Asn Met
Pro Met Cys Asn
Pro Met Asn Cys
Pro Asn Cys Met
Pro Asn Met Cys
Gln Ala Asp Met
C17H29N5O8S (463.17367540000004)
Gln Ala Met Asp
C17H29N5O8S (463.17367540000004)
Gln Cys Asp Val
C17H29N5O8S (463.17367540000004)
Gln Cys Val Asp
C17H29N5O8S (463.17367540000004)
Gln Asp Ala Met
C17H29N5O8S (463.17367540000004)
Gln Asp Cys Val
C17H29N5O8S (463.17367540000004)
Gln Asp Asp Ser
C16H25N5O11 (463.15504999999996)
Gln Asp Met Ala
C17H29N5O8S (463.17367540000004)
Gln Asp Ser Asp
C16H25N5O11 (463.15504999999996)
Gln Asp Val Cys
C17H29N5O8S (463.17367540000004)
Gln Glu Gly Met
C17H29N5O8S (463.17367540000004)
Gln Glu Met Gly
C17H29N5O8S (463.17367540000004)
Gln Gly Glu Met
C17H29N5O8S (463.17367540000004)
Gln Gly Met Glu
C17H29N5O8S (463.17367540000004)
Gln Met Ala Asp
C17H29N5O8S (463.17367540000004)
Gln Met Asp Ala
C17H29N5O8S (463.17367540000004)
Gln Met Glu Gly
C17H29N5O8S (463.17367540000004)
Gln Met Gly Glu
C17H29N5O8S (463.17367540000004)
Gln Ser Asp Asp
C16H25N5O11 (463.15504999999996)
Gln Val Cys Asp
C17H29N5O8S (463.17367540000004)
Gln Val Asp Cys
C17H29N5O8S (463.17367540000004)
Ser Asp Asp Gln
C16H25N5O11 (463.15504999999996)
Ser Asp Glu Asn
C16H25N5O11 (463.15504999999996)
Ser Asp Gly Trp
Ser Asp Asn Glu
C16H25N5O11 (463.15504999999996)
Ser Asp Gln Asp
C16H25N5O11 (463.15504999999996)
Ser Asp Trp Gly
Ser Glu Asp Asn
C16H25N5O11 (463.15504999999996)
Ser Glu Asn Asp
C16H25N5O11 (463.15504999999996)
Ser Gly Asp Trp
Ser Gly Trp Asp
Ser Asn Asp Glu
C16H25N5O11 (463.15504999999996)
Ser Asn Glu Asp
C16H25N5O11 (463.15504999999996)
Ser Gln Asp Asp
C16H25N5O11 (463.15504999999996)
Ser Trp Asp Gly
Ser Trp Gly Asp
Thr Asp Asp Asn
C16H25N5O11 (463.15504999999996)
Thr Asn Asp Asp
C16H25N5O11 (463.15504999999996)
Val Cys Asp Gln
C17H29N5O8S (463.17367540000004)
Val Cys Glu Asn
C17H29N5O8S (463.17367540000004)
Val Cys Asn Glu
C17H29N5O8S (463.17367540000004)
Val Cys Gln Asp
C17H29N5O8S (463.17367540000004)
Val Asp Cys Gln
C17H29N5O8S (463.17367540000004)
Val Asp Gln Cys
C17H29N5O8S (463.17367540000004)
Val Glu Cys Asn
C17H29N5O8S (463.17367540000004)
Val Glu Asn Cys
C17H29N5O8S (463.17367540000004)
Val Asn Cys Glu
C17H29N5O8S (463.17367540000004)
Val Asn Glu Cys
C17H29N5O8S (463.17367540000004)
Val Gln Cys Asp
C17H29N5O8S (463.17367540000004)
Val Gln Asp Cys
C17H29N5O8S (463.17367540000004)
Trp Asp Gly Ser
Trp Asp Ser Gly
Trp Gly Asp Ser
Trp Gly Ser Asp
Trp Ser Asp Gly
Trp Ser Gly Asp
4-[(5-Amino-1-methyl-1H-indol-3-yl)methyl]-3-methoxy-N-[(2-methylphenyl)sulfonyl]benzamide
C25H25N3O4S (463.15656900000005)
His-Trp-OH
C23H21N5O6 (463.14917660000003)
Trp-His-OH
C23H21N5O6 (463.14917660000003)
Pinotin A aglycone
Isopeonidin 3-galactoside
Isopeonidin 3-glucoside
Moricizine hydrochloride
C22H26ClN3O4S (463.1332466000001)
D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker
4-Nitrophenyl 2-O-α-D-Glucopyranosyl-α-D-glucopyranoside
N-(5-chloro-2-methylphenyl)-4-[(5-chloro-2-methylphenyl)azo]-3-hydroxynaphthalene-2-carboxamide
Amodiaquin dihydrochloride dihydrate
C20H22ClN3O .2H2O .2HCl (463.1196148)
Setileuton
C471 - Enzyme Inhibitor > C1322 - Lipooxygenase Inhibitor
4-Nitrophenyl 6-O-(a-D-glucopyranosyl)-b-D-glucopyranoside
2(1H)-QUINOLINETHIONE, 7-[4-[4-(2,3-DICHLOROPHENYL)-1-PIPERAZINYL]BUTOXY]-3,4-DIHYDRO-
C23H27Cl2N3OS (463.12517920000005)
4-Nitrophenyl2-O-(a-D-mannopyranosyl)-a-D-mannopyranoside
2-[N-(2-cyanoethyl)-4-[(2,6-dichloro-4-nitrophenyl)azo]-3-methylanilino]ethyl acetate
C20H19Cl2N5O4 (463.08140340000006)
4-Nitrophenyl 2-O-(b-D-glucopyranosyl)-b-D-glucopyranoside
1-((4-CHLOROPHENYL)SULFONYL)-4-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)PIPERAZINE
C21H27BClN3O4S (463.1503762000001)
ETHYL 5-(2,4-BIS(BENZYLOXY)-5-CHLOROPHENYL)ISOXAZOLE-3-CARBOXYLATE
C26H22ClNO5 (463.11864320000007)
[2-[(2-chlorophenyl)carbamoyl]-4-(2,4-difluorophenyl)phenyl] benzoate
C26H16ClF2NO3 (463.0786720000001)
[2-[(3-chlorophenyl)carbamoyl]-4-(2,4-difluorophenyl)phenyl] benzoate
C26H16ClF2NO3 (463.0786720000001)
[2-[(4-chlorophenyl)carbamoyl]-4-(2,4-difluorophenyl)phenyl] benzoate
C26H16ClF2NO3 (463.0786720000001)
2-ethoxyethyl [2-[(2-chloro-4-nitrophenyl)azo]-5-(diethylamino)phenyl]carbamate
C21H26ClN5O5 (463.1622376000001)
N-(6-Methoxy-3-pyridinyl)-1,2-dimethyl-N-{[5-(2-methylphenyl)-2-p yridinyl]methyl}-1H-imidazole-4-sulfonamide
C24H25N5O3S (463.16780200000005)
N-(4-chloro-2-methylphenyl)-4-[(4-chloro-2-methylphenyl)azo]-3-hydroxynaphthalene-2-carboxamide
4-Nitrophenyl3-O-(b-D-glucopyranosyl)-b-D-glucopyranoside
Native Streptomyces griseus Aminopeptidase I
C17H25N7O4.2[HCl] (463.1501482)
4-nitrophenyl 3-o-(a-d-mannopyranosyl)-a-d-mannopyranoside
(2R,5S,13aR)-8-methoxy-7,9-dioxo-N-(2,4,6-trifluorobenzyl)-2,3,4,5,7,9,13,13a-octahydro-2,5-methanopyrido[1,2:4,5]pyrazino[2,1-b][1,3]oxazepine-10-carboxamide
C22H20F3N3O5 (463.13549860000006)
2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucopyranuronosyloxy)-5,7-dihydroxy-1-benzopyrylium
C21H19O12 (463.08764740000004)
Pelitrexol
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2692 - Glycinamide Ribonucleotide Formyltransferase Inhibitor
1-(diaminomethylidene)-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]urea; 2,4,6-trinitrophenol
Berzosertib
C24H25N5O3S (463.16780200000005)
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
3-[[(2,4-Dinitrophenyl)-oxomethyl]amino]benzoic acid [2-(4-methylphenyl)-2-oxoethyl] ester
FM19G11 is a hypoxia-inducible factor-1-alpha (HIF-1α) inhibitor, and it inhibits hypoxia-induced luciferase activity with an IC50 of 80 nM in HeLa cells. FM19G11 modulates other signaling pathways, including mTOR and PI3K/Akt/eNOS, when the HIF-1α pathway is inactivated under normoxic conditions[1][2].
N-(4-methyl-5-oxo-2-[1]benzopyrano[4,3-b]pyridinyl)-4-(1-pyrrolidinylsulfonyl)benzamide
C24H21N3O5S (463.12018560000007)
[(2R,3S,4R,5R,6R)-5-Acetamido-4,6-dihydroxy-3-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl hydrogen sulfate
5-Fluoro-N-((1S)-1-phenylpropyl)-2-((quinolin-8-ylsulfonyl)amino)benzamide
C25H22FN3O3S (463.13658340000006)
2-Methylthio-N6-isopentenyl-adenosine-5-monophosphate
C16H26N5O7PS (463.12904960000003)
Amodiaquin dihydrochloride dihydrate
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
Peonidin 3-galactoside
Peonidin 3-galactoside is a member of the class of compounds known as anthocyanidin-3-o-glycosides. Anthocyanidin-3-o-glycosides are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C3-position. Peonidin 3-galactoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Peonidin 3-galactoside can be found in a number of food items such as mango, red raspberry, rubus (blackberry, raspberry), and bilberry, which makes peonidin 3-galactoside a potential biomarker for the consumption of these food products.
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-3-olate
C21H19O12- (463.08764740000004)
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-8-methylsulfanyl-N-sulfooxyoctanimidothioate
C15H29NO9S3 (463.10043840000003)
(4S,4aS,5aS,6S,12aR)-2-carbamoyl-7-chloro-4-(dimethylazaniumyl)-6,10,12a-trihydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-1,11-diolate
1-[2-[5-[(3-Amino-3-carboxypropyl)amino]-3-carboxy-3-hydroxy-5-oxopentanoyl]oxyethyl]-2-hydroxy-5-oxopyrrolidine-2-carboxylic acid
1-[3-[[5-(2-Aminoethoxy)-3-carboxy-3-hydroxy-5-oxopentanoyl]amino]-1-carboxypropyl]-2-hydroxy-5-oxopyrrolidine-2-carboxylic acid
bis(5-amino-4,8-dioxo-1,3,2-dioxazocan-2-yl) 2-aminopentanedioate
C15H21N5O12 (463.11866660000004)
3-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-2-(4-hydroxy-3,5-dimethoxyphenyl)chromenylium-5,7-diol
7-[[1-Amino-2-(2-amino-1,3-thiazol-5-yl)-2-methoxyethylidene]amino]-3-[(1-methylpyrrol-1-ium-1-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
4-[(7-Chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;hydron;dichloride;dihydrate
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents
3-[4-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenoxy]-N-methylbenzamide
C22H17ClF3N3O3 (463.09104780000007)
4-(3-{2-[(ethoxycarbonyl)amino]-10H-phenothiazin-10-yl}-3-oxopropyl)morpholin-4-ium chloride
C22H26ClN3O4S (463.1332466000001)
D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
beta-D-Galp6S-(1->4)-beta-D-GlcpNAc
An amino disaccharide that consists of N-acetyl-beta-D-glucosamine having a 6-O-sulfo-beta-D-galactosyl residue attached at position 4.
2-[[6,6-dimethyl-2-(propan-2-ylthio)-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-yl]thio]-N-(2-furanylmethyl)acetamide
2-[[3-(2,4-difluorophenyl)-4-oxo-2-quinazolinyl]thio]-N-(2,3-dihydro-1H-inden-5-yl)acetamide
beta-D-Galp3S-(1->3-)-beta-D-GlcpNAc
An amino disaccharide composed of 3-sulfated beta-D-galactose and N-acetyl-beta-D-glucosaminyl residues in beta-(1->3) linkage.
9-(3-bromo-4-hydroxyphenyl)-10-phenyl-3,4,5,6,7,9-hexahydro-2H-acridine-1,8-dione
C25H22BrNO3 (463.07829620000007)
N-(1,3-benzodioxol-5-yl)-2-[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide
C21H16F3N3O4S (463.08135720000007)
1-[2-[[[2-Chloro-4-(trifluoromethyl)anilino]-oxomethyl]amino]-2-methyl-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester
C20H25ClF3N3O4 (463.14855960000006)
2-Ethoxy-3-pyridinecarboxylic acid [2-[2-methyl-5-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester
N-[2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-1,3-benzodioxole-5-carboxamide
C25H22ClN3O4 (463.12987620000007)
(E)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylphenyl)sulfonylprop-2-enenitrile
C24H25N5O3S (463.16780200000005)
N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-2,2,2-trifluoroacetamide
C23H24F3N3O4 (463.17188200000004)
3-[2-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]spiro[6,7-dihydro-5H-1-benzothiophene-4,5-imidazolidine]-2,4-dione
C25H25N3O4S (463.15656900000005)
2-chloro-N-[1-[oxo(10-phenothiazinyl)methyl]-4-piperidinyl]benzamide
C25H22ClN3O2S (463.11211820000005)
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(3-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
beta-D-Galp3S-(1->3-)-alpha-D-GalpNAc
An amino disaccharide composed of 3-sulfated beta-D-galactose and N-acetyl-alpha-D-galactosaminyl residues in beta-(1->3) linkage.
3-(2,3-dihydroindol-1-ylsulfonyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)benzamide
3-[(3aR,4S,9bR)-1-(4-fluorophenyl)sulfonyl-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile
C25H22FN3O3S (463.13658340000006)
3-[(3aS,4S,9bS)-1-(4-fluorophenyl)sulfonyl-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile
C25H22FN3O3S (463.13658340000006)
3-[(3aS,4R,9bS)-1-(4-fluorophenyl)sulfonyl-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile
C25H22FN3O3S (463.13658340000006)
(6R,7S,8S)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
(6S,7S,8R)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
(6R,7S,8R)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
3-[(3aR,4R,9bR)-1-(4-fluorophenyl)sulfonyl-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile
C25H22FN3O3S (463.13658340000006)
(6R,7R,8S)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
(6R,7R,8R)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
(6S,7R,8R)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
(6S,7R,8S)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
(6S,7S,8S)-N-(4-fluorophenyl)-7-[4-(3-fluorophenyl)phenyl]-8-(hydroxymethyl)-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
C26H23F2N3O3 (463.17073919999996)
beta-D-Galp3S-(1->4)-beta-D-GlcpNAc
An amino disaccharide that consists of N-acetyl-beta-D-glucosamine having a 3-sulfated beta-D-galactosyl residue attached at position 4.
beta-D-Galp4S-(1->4)-beta-D-GlcpNAc
An amino disaccharide that consists of N-acetyl-beta-D-glucosamine having a 4-O-sulfo-beta-D-galactosyl residue attached at position 4.
2-acetamido-2-deoxy-3-O-(6-O-sulfo-beta-D-glucosyl)-beta-D-galactose
An amino disaccharide consisting of N-acetyl-beta-D-galactosamine having a 6-O-sulfo-beta-D-glucosyl residue attached at the 3-position.
6-(N-acetyl-D-glucosaminyl-1-phosphono)-D-mannose
A mannose phosphate that is D-mannose phosphorylated at position 6 by a N-acetyl-D-glucosaminyl-1-phosphono group. Found in the milk of giant pandas.
3,4,5-Trihydroxy-6-[2-hydroxy-5-(3,5,7-trihydroxychromenylium-2-yl)phenoxy]oxane-2-carboxylic acid
C21H19O12+ (463.08764740000004)
6-[2-(3,4-Dihydroxyphenyl)-3,5-dihydroxychromenylium-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
C21H19O12+ (463.08764740000004)
N-(3-chloro-4-fluorophenyl)-6-[3-(4-hydroxymorpholin-4-ium-4-yl)propoxy]-7-methoxyquinazolin-4-amine
delphinidin 3-O-beta-D-galactoside(1-)
C21H19O12- (463.08764740000004)
(E)-3-(2,4-dichlorophenyl)-N-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]prop-2-enamide
D002317 - Cardiovascular Agents > D026902 - Potassium Channel Blockers D049990 - Membrane Transport Modulators
myricitrin(1-)
C21H19O12 (463.08764740000004)
A flavonoid oxoanion that is the conjugate base of myricitrin arising from selective deprotonation of the 7-hydroxy group; major species at pH 7.3.
4-nitrophenyl beta-sophoroside
A disaccharide derivative consisting of 4-nitrophenyl beta-D-glucoside having a beta-D-glucosyl residue attached at the 2-position.
quercetin 3-O-beta-D-glucopyranoside(1-)
C21H19O12 (463.08764740000004)
A flavonoid oxoanion resulting from the deprotonation of the hydroxy group at position 7 of the flavone moiety of quercetin. The major species at pH 7.3.
Peonidin 3-O-beta-D-glucoside
An anthocyanin cation that is the 3-O-beta-D-glucoside of peonidin (methylcyanidin).
CD73-IN-4
CD73-IN-4 is a potent and selective methylenephosphonic acid CD73 inhibitor, with an IC50 of 2.6 nM for human CD73. CD73-IN-4 is potential for the research of cancer immunology[1].
ERK1/2 inhibitor 7
ERK1/2 inhibitor 7 is a potent ERK inhibitor with an IC50 of 0.94 nM for ERK2 (WO2021110168A1, WX006)[1].
MGL-IN-1
MGL-IN-1 is a potent and selective irreversible MGL (β-lactam-based monoacylglycerol lipase) inhibitor. MGL-IN-1 alleviates symptoms in a MS model in vivo and exhibits analgesic effects in an acute inflammatory pain model in vivo. MGL-IN-1 displays high membrane permeability and brain penetrant[1].