Exact Mass: 449.1257

Exact Mass Matches: 449.1257

Found 404 metabolites which its exact mass value is equals to given mass value 449.1257, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

6-(Methylthio)hexyl glucosinolate

{[(e)-[7-(methylsulphanyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}heptylidene]amino]oxy}sulphonic acid

C14H27NO9S3 (449.0848)

6-(Methylthio)hexyl glucosinolate is found in horseradish. 6-(Methylthio)hexyl glucosinolate is present in Arabidopsis thaliana and other crucifers. Present in Arabidopsis thaliana and other crucifers. 6-(Methylthio)hexyl glucosinolate is found in horseradish.

Cyanidin 3-glucoside

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1lambda4-chromen-1-ylium

[C21H21O11]+ (449.1084)

Cyanidin 3-glucoside, also known as chrysanthenin or cyanidin 3-glucoside chloride (CAS: 7084-24-4), belongs to the class of organic compounds known as pyranones and derivatives. Pyranones and derivatives are compounds containing a pyran ring which bears a ketone. Cyanidin 3-glucoside is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, cyanidin 3-glucoside is found, on average, in the highest concentration within a few different foods, such as black elderberries, rubus (blackberry, raspberry), and bilberries and in a lower concentration in redcurrants, strawberries, and sweet oranges. Cyanidin 3-glucoside has also been detected, but not quantified in, several different foods, such as common pea, peaches, Tartary buckwheats, soft-necked garlic, and fats and oils. This could make cyanidin 3-glucoside a potential biomarker for the consumption of these foods. Cyanidin (and its glycosides) is the most commonly occurring of the anthocyanins, a widespread group of pigments responsible for the red-blue colour of many fruits and vegetables (PMID: 14711454). BioTransformer predicts that cyanidin 3-glucoside is a product of cyanidin 3-sophoroside metabolism via a glycoside-hydrolysis reaction occurring in human gut microbiota and catalyzed by the EC.3.2.1.X enzyme (PMID: 30612223). Acquisition and generation of the data is financially supported in part by CREST/JST. Found in many plants and fruits, e.g. cherries, olives and grapes

Cyhalothrin

Cyclopropanecarboxylicacid, 3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethyl-,(S)-cyano(3-phenoxyphenyl)methyl ester, (1R,3R)-

C23H19ClF3NO3 (449.1005)

D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals Same as: D07762

Cyanidin 5-O-glucoside

C21H21O11 (449.1084)

Cyanidin 3-galactoside

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

[C21H21O11]+ (449.1084)

Isolated from numerous plants including cranberry (Vaccinium vitis-idaea), red pears and pistachio (Pistacia vera). Cyanidin 3-galactoside is found in many foods, some of which are corn, blackcurrant, strawberry, and pomes. Cyanidin 3-galactoside is found in american cranberry. Cyanidin 3-galactoside is isolated from numerous plants including cranberry (Vaccinium vitis-idaea), red pears and pistachio (Pistacia vera). Acquisition and generation of the data is financially supported in part by CREST/JST.

Flupenthixol

C23H26F3N3OS (449.1749)

Cyanidin 4'-glucoside

3,5,7-trihydroxy-2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-1λ⁴-chromen-1-ylium

C21H21O11+ (449.1084)

Isolated from okra petals (Hibiscus esculentus). Cyanidin 4-glucoside is found in garden onion, green vegetables, and okra. Cyanidin 4-glucoside is found in garden onion. Cyanidin 4-glucoside is isolated from okra petals (Hibiscus esculentus).

Glisoxepide

N-{2-[4-({[(azepan-1-yl)carbamoyl]amino}sulfonyl)phenyl]ethyl}-5-methyl-1,2-oxazole-3-carboxamide

C20H27N5O5S (449.1733)

Glisoxepide is one of the sulphonamide-derived oral antidiabetic drugs. It inhibits the uptake of bile acids into isolated rat hepatocytes. However it inhibits taurocholate uptake only in the absence of sodium ions. Glisoxepide uptake could be further inhibited by blockers of the hepatocellular monocarboxylate transporter, by the loop diuretic bumetanide, by 4,4-diisothiocyano-2,2-stilbenedisulfonate (DIDS) and by sulphate. These results are consistent with the transport of glisoxepide via the transport system for the unconjugated bile acid cholate. (PMID:1618280, 9017793). A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BB - Sulfonylureas C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C97936 - Sulfonylurea Antidiabetic Agent

Cyanidin 7-glucoside

2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C21H21O11+ (449.1084)

Cyanidin 7-glucoside is found in fruits. Cyanidin 7-glucoside is isolated from blackberry (Rubus fruticosus). Isolated from blackberry (Rubus fruticosus). Cyanidin 7-glucoside is found in fruits.

Carnocin CP 5

{[1,4-dioxo-3-(1λ⁵-pyridin-1-ylium-1-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]imino}({4-[(1-hydroxyethylidene)amino]phenyl})dioxo-λ⁶-sulphanuide

C23H19N3O5S (449.1045)

Carnocin CP 5 is found in fishes. Carnocin CP 5 is produced by Carnobacterium piscicola CP5. Production by Carnobacterium piscicola CP5. Carnocin CP 5 is found in fishes.

Bictegravir

5-hydroxy-3,6-dioxo-N-[(2,4,6-trifluorophenyl)methyl]-12-oxa-2,9-diazatetracyclo[11.2.1.0^{2,11}.0^{4,9}]hexadeca-4,7-diene-7-carboxamide

C21H18F3N3O5 (449.1198)

Commodore

Cyano(4-phenoxyphenyl)methyl 3-(2-chloro-3,3,3-trifluoroprop-1-en-1-yl)-2,2-dimethylcyclopropane-1-carboxylic acid

C23H19ClF3NO3 (449.1005)

Crizotinib

3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(piperidin-4-yl)-1H-pyrazol-4-yl]pyridin-2-amine

C21H22Cl2FN5O (449.1185)

Cyhalothrin

Cyclopropanecarboxylic acid, 3-(2-chloro-3,3,3-trifluoro-1-propenyl)-2,2-dimethyl-, cyano(3-phenoxyphenyl)methyl ester

C23H19ClF3NO3 (449.1005)

N-[(5-{2-[(6R)-2-Amino-4-oxo-3,4,5,6,7,8-hexahydropyrido[2,3-D]pyrimidin-6-YL]ethyl}-2-thienyl)carbonyl]-L-glutamic acid

C19H23N5O6S (449.1369)

Cyanidin 3-O-alpha-L-galactoside

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C21H21O11 (449.1084)

Cyanidin 3-o-alpha-l-galactoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cyanidin 3-o-alpha-l-galactoside can be found in highbush blueberry, which makes cyanidin 3-o-alpha-l-galactoside a potential biomarker for the consumption of this food product.

Delphinidin 3-rhamnoside

5,7-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium

C21H21O11+ (449.1084)

Delphinidin 3-rhamnoside 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. Delphinidin 3-rhamnoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Delphinidin 3-rhamnoside can be found in blackcurrant, which makes delphinidin 3-rhamnoside a potential biomarker for the consumption of this food product.

Cyanidin 3-O-arabinoside

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1lambda4-chromen-1-ylium

C21H21O11 (449.1084)

Petunidin 3-arabinoside

2- (3,4-Dihydroxy-5-methoxyphenyl) -5,7-dihydroxy-3- (beta-D-arabinofuranosyloxy) -1-benzopyrylium

C21H21O11 (449.1084)

Asterin

2- (3,4-Dihydroxyphenyl) -3- (beta-D-glucopyranosyloxy) -5,7-dihydroxy-1-benzopyrylium

C21H21O11+ (449.1084)

4-(tert-Butyl)-N-({[2-methyl-5-(morpholinosulfonyl)-3-furyl]carbonyl}oxy)benzenecarboximidamide

C21H27N3O6S (449.162)

Maybridge1_008405

C23H22F3NO3S (449.1272)

4-[[4-[Hydroxy(4-methoxyphenyl)methyl]-5-[(4-hydroxyphenyl)methyl]-1-methyl-1H-imidazol-2-yl]amino]-1-methyl-1H-imidazole-2,5-dione

C23H23N5O5 (449.1699)

trichanthin-A

C22H27NO7S (449.1508)

6-(o-hydroxybenzylamino)-2-methylthio-9-beta-glucofuranosilpurine

C19H23N5O6S (449.1369)

Met Tyr His

C20H27N5O5S (449.1733)

Met Trp Asn

C20H27N5O5S (449.1733)

Tyr His Met

C20H27N5O5S (449.1733)

Asn Trp Met

C20H27N5O5S (449.1733)

His Tyr Met

C20H27N5O5S (449.1733)

Met His Tyr

C20H27N5O5S (449.1733)

Tyr Met His

C20H27N5O5S (449.1733)

3-(1-(2,6-dichloro-3-fluorophenyl)ethoxy)-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)pyridin-2-amine

C21H22Cl2FN5O (449.1185)

Crizotinib (PF-02341066)

C21H22Cl2FN5O (449.1185)

Ideain chloride

[C21H21O11]+ (449.1084)

Cyanidin-3-glucoside chloride

[C21H21O11]+ (449.1084)

Cyanidin 3-glucoside

[C21H21O11]+ (449.1084)

Cyanidin 3-galactoside

[C21H21O11]+ (449.1084)

Glucolesquerellin

{[(E)-[7-(methylsulfanyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}heptylidene]amino]oxy}sulfonic acid

C14H27NO9S3 (449.0848)

http://casmi-contest.org/challenges-cat1-2.shtml; CASMI2012 LC Challenge 3

cyanidin-3-o-galactoside

C21H21O11 (449.1084)

Cyanidin-3-O-glucoside

C21H21O11 (449.1084)

cyanidin-3-o-galactoside

[C21H21O11]+ (449.1084)

Annotation level-1

Cyanidin-3-O-glucoside

[C21H21O11]+ (449.1084)

Annotation level-1

Kuromanin

[C21H21O11]+ (449.1084)

Ala Ala Cys Trp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanoic acid

C20H27N5O5S (449.1733)

Ala Ala Trp Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]propanamido]-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanoic acid

C20H27N5O5S (449.1733)

Ala Cys Ala Trp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]propanamido]-3-(1H-indol-3-yl)propanoic acid

C20H27N5O5S (449.1733)

Ala Cys Glu Gln

(4S)-4-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-4-{[(1S)-3-carbamoyl-1-carboxypropyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Ala Cys Gln Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-4-carbamoylbutanamido]pentanedioic acid

C16H27N5O8S (449.158)

Ala Cys Trp Ala

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanamido]propanoic acid

C20H27N5O5S (449.1733)

Ala Asp Met Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Ala Asp Asn Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carboxypropanamido]-3-carbamoylpropanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Ala Glu Cys Gln

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-3-sulfanylpropanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Ala Glu Gln Cys

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1S)-3-carbamoyl-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Ala Met Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Ala Met Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-3-carbamoylpropanamido]butanedioic acid

C16H27N5O8S (449.158)

Ala Asn Asp Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carbamoylpropanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Ala Asn Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-carbamoylpropanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C16H27N5O8S (449.158)

Ala Gln Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carbamoylbutanamido]-3-sulfanylpropanamido]pentanedioic acid

C16H27N5O8S (449.158)

Ala Gln Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-4-carbamoylbutanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Ala Trp Ala Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-indol-3-yl)propanamido]propanamido]-3-sulfanylpropanoic acid

C20H27N5O5S (449.1733)

Ala Trp Cys Ala

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanamido]propanoic acid

C20H27N5O5S (449.1733)

Cys Ala Ala Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]propanamido]-3-(1H-indol-3-yl)propanoic acid

C20H27N5O5S (449.1733)

Cys Ala Glu Gln

(4S)-4-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-4-{[(1S)-3-carbamoyl-1-carboxypropyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Cys Ala Gln Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-4-carbamoylbutanamido]pentanedioic acid

C16H27N5O8S (449.158)

Cys Ala Trp Ala

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-(1H-indol-3-yl)propanamido]propanoic acid

C20H27N5O5S (449.1733)

Cys Cys Pro Gln

(2S)-2-{[(2S)-1-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanoic acid

C16H27N5O6S2 (449.1403)

Cys Cys Gln Pro

(2S)-1-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-4-carbamoylbutanoyl]pyrrolidine-2-carboxylic acid

C16H27N5O6S2 (449.1403)

Cys Asp Gly Arg

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]acetamido}-5-carbamimidamidopentanoic acid

C15H27N7O7S (449.1693)

Cys Asp Asn Val

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]-3-carbamoylpropanamido]-3-methylbutanoic acid

C16H27N5O8S (449.158)

Cys Asp Arg Gly

(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S)-4-carbamimidamido-1-[(carboxymethyl)carbamoyl]butyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Cys Asp Val Asn

(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S)-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Cys Glu Ala Gln

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S)-1-{[(1S)-3-carbamoyl-1-carboxypropyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Cys Glu Gln Ala

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S)-3-carbamoyl-1-{[(1S)-1-carboxyethyl]carbamoyl}propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Cys Gly Asp Arg

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-carboxypropanamido]-5-carbamimidamidopentanoic acid

C15H27N7O7S (449.1693)

Cys Gly Arg Asp

(2S)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-5-carbamimidamidopentanamido]butanedioic acid

C15H27N7O7S (449.1693)

Cys Asn Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C16H27N5O8S (449.158)

Cys Asn Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-methylbutanamido]butanedioic acid

C16H27N5O8S (449.158)

Cys Pro Cys Gln

(2S)-2-[(2R)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-4-carbamoylbutanoic acid

C16H27N5O6S2 (449.1403)

Cys Pro Gln Cys

(2R)-2-[(2S)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanamido]-3-sulfanylpropanoic acid

C16H27N5O6S2 (449.1403)

Cys Gln Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carbamoylbutanamido]propanamido]pentanedioic acid

C16H27N5O8S (449.158)

Cys Gln Cys Pro

(2S)-1-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carbamoylbutanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C16H27N5O6S2 (449.1403)

Cys Gln Glu Ala

(4S)-4-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carbamoylbutanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Cys Gln Pro Cys

(2R)-2-{[(2S)-1-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C16H27N5O6S2 (449.1403)

Cys Arg Asp Gly

(3S)-3-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C15H27N7O7S (449.1693)

Cys Arg Gly Asp

(2S)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]acetamido}butanedioic acid

C15H27N7O7S (449.1693)

Cys Val Asp Asn

(3S)-3-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylbutanamido]-3-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Cys Val Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylbutanamido]-3-carbamoylpropanamido]butanedioic acid

C16H27N5O8S (449.158)

Cys Trp Ala Ala

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanamido]propanamido]propanoic acid

C20H27N5O5S (449.1733)

Asp Ala Met Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-4-(methylsulfanyl)butanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Asp Ala Asn Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]propanamido]-3-carbamoylpropanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Asp Cys Gly Arg

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]acetamido}-5-carbamimidamidopentanoic acid

C15H27N7O7S (449.1693)

Asp Cys Asn Val

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-methylbutanoic acid

C16H27N5O8S (449.158)

Asp Cys Arg Gly

(3S)-3-amino-3-{[(1R)-1-{[(1S)-4-carbamimidamido-1-[(carboxymethyl)carbamoyl]butyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Asp Cys Val Asn

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-methylbutanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Asp Asp Asn Ser

(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C15H23N5O11 (449.1394)

Asp Asp Ser Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carboxypropanamido]-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C15H23N5O11 (449.1394)

Asp Gly Cys Arg

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-3-sulfanylpropanamido]-5-carbamimidamidopentanoic acid

C15H27N7O7S (449.1693)

Asp Gly Met Gln

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-4-(methylsulfanyl)butanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Asp Gly Gln Met

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carboxypropanamido]acetamido}-4-carbamoylbutanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Asp Gly Arg Cys

(3S)-3-amino-3-[({[(1S)-4-carbamimidamido-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butyl]carbamoyl}methyl)carbamoyl]propanoic acid

C15H27N7O7S (449.1693)

Asp Met Ala Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]propanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Asp Met Gly Gln

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]acetamido}-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Asp Met Asn Ala

(3S)-3-amino-3-{[(1S)-1-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asp Met Gln Gly

(3S)-3-amino-3-{[(1S)-1-{[(1S)-3-carbamoyl-1-[(carboxymethyl)carbamoyl]propyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asp Asn Ala Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]propanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Asp Asn Cys Val

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-methylbutanoic acid

C16H27N5O8S (449.158)

Asp Asn Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C15H23N5O11 (449.1394)

Asp Asn Met Ala

(3S)-3-amino-3-{[(1S)-2-carbamoyl-1-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asp Asn Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]butanedioic acid

C15H23N5O11 (449.1394)

Asp Asn Val Cys

(3S)-3-amino-3-{[(1S)-2-carbamoyl-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-methylpropyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asp Gln Gly Met

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carbamoylbutanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Asp Gln Met Gly

(3S)-3-amino-3-{[(1S)-3-carbamoyl-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}propyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asp Arg Cys Gly

(3S)-3-amino-3-{[(1S)-4-carbamimidamido-1-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}butyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Asp Arg Gly Cys

(3S)-3-amino-3-{[(1S)-4-carbamimidamido-1-[({[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}methyl)carbamoyl]butyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Asp Ser Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C15H23N5O11 (449.1394)

Asp Ser Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]butanedioic acid

C15H23N5O11 (449.1394)

Asp Val Cys Asn

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-3-sulfanylpropanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Asp Val Asn Cys

(3S)-3-amino-3-{[(1S)-1-{[(1S)-2-carbamoyl-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}ethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Glu Ala Cys Gln

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-3-sulfanylpropanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Glu Ala Gln Cys

(4S)-4-amino-4-{[(1S)-1-{[(1S)-3-carbamoyl-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Cys Ala Gln

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-sulfanylpropanamido]propanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Glu Cys Gln Ala

(4S)-4-amino-4-{[(1R)-1-{[(1S)-3-carbamoyl-1-{[(1S)-1-carboxyethyl]carbamoyl}propyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Gly Met Asn

(4S)-4-amino-4-[({[(1S)-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}methyl)carbamoyl]butanoic acid

C16H27N5O8S (449.158)

Glu Gly Asn Met

(4S)-4-amino-4-[({[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}methyl)carbamoyl]butanoic acid

C16H27N5O8S (449.158)

Glu Met Gly Asn

(4S)-4-amino-4-{[(1S)-1-[({[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}methyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Met Asn Gly

(4S)-4-amino-4-{[(1S)-1-{[(1S)-2-carbamoyl-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Asn Gly Met

(4S)-4-amino-4-{[(1S)-2-carbamoyl-1-[({[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}methyl)carbamoyl]ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Asn Met Gly

(4S)-4-amino-4-{[(1S)-2-carbamoyl-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Gln Ala Cys

(4S)-4-amino-4-{[(1S)-3-carbamoyl-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}ethyl]carbamoyl}propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Glu Gln Cys Ala

(4S)-4-amino-4-{[(1S)-3-carbamoyl-1-{[(1R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gly Cys Asp Arg

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-3-carboxypropanamido]-5-carbamimidamidopentanoic acid

C15H27N7O7S (449.1693)

Gly Cys Arg Asp

(2S)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]butanedioic acid

C15H27N7O7S (449.1693)

Gly Asp Cys Arg

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-3-sulfanylpropanamido]-5-carbamimidamidopentanoic acid

C15H27N7O7S (449.1693)

Gly Asp Met Gln

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Gly Asp Gln Met

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carboxypropanamido]-4-carbamoylbutanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Gly Asp Arg Cys

(3S)-3-(2-aminoacetamido)-3-{[(1S)-4-carbamimidamido-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Gly Glu Met Asn

(4S)-4-(2-aminoacetamido)-4-{[(1S)-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gly Glu Asn Met

(4S)-4-(2-aminoacetamido)-4-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gly Gly Met Trp

(2S)-2-[(2S)-2-[2-(2-aminoacetamido)acetamido]-4-(methylsulfanyl)butanamido]-3-(1H-indol-3-yl)propanoic acid

C20H27N5O5S (449.1733)

Gly Gly Trp Met

(2S)-2-[(2S)-2-[2-(2-aminoacetamido)acetamido]-3-(1H-indol-3-yl)propanamido]-4-(methylsulfanyl)butanoic acid

C20H27N5O5S (449.1733)

Gly Met Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Gly Met Glu Asn

(4S)-4-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-4-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gly Met Gly Trp

(2S)-2-{2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]acetamido}-3-(1H-indol-3-yl)propanoic acid

C20H27N5O5S (449.1733)

Gly Met Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-carbamoylpropanamido]pentanedioic acid

C16H27N5O8S (449.158)

Gly Met Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-4-carbamoylbutanamido]butanedioic acid

C16H27N5O8S (449.158)

Gly Met Trp Gly

2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-(methylsulfanyl)butanamido]-3-(1H-indol-3-yl)propanamido]acetic acid

C20H27N5O5S (449.1733)

Gly Asn Glu Met

(4S)-4-[(2S)-2-(2-aminoacetamido)-3-carbamoylpropanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gly Asn Met Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carbamoylpropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C16H27N5O8S (449.158)

Gly Gln Asp Met

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-carbamoylbutanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Gly Gln Met Asp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-carbamoylbutanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C16H27N5O8S (449.158)

Gly Arg Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]butanedioic acid

C15H27N7O7S (449.1693)

Gly Arg Asp Cys

(3S)-3-[(2S)-2-(2-aminoacetamido)-5-carbamimidamidopentanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Gly Trp Gly Met

(2S)-2-{2-[(2S)-2-(2-aminoacetamido)-3-(1H-indol-3-yl)propanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C20H27N5O5S (449.1733)

Gly Trp Met Gly

2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-indol-3-yl)propanamido]-4-(methylsulfanyl)butanamido]acetic acid

C20H27N5O5S (449.1733)

Met Tyr His

C20H27N5O5S1 (449.1733)

Met Asn Trp

C20H27N5O5S1 (449.1733)

His Met Tyr

C20H27N5O5S1 (449.1733)

Tyr His Met

C20H27N5O5S1 (449.1733)

Tyr Met His

C20H27N5O5S1 (449.1733)

Met Ala Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]propanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Met Ala Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]propanamido]-3-carbamoylpropanamido]butanedioic acid

C16H27N5O8S (449.158)

Met Asp Ala Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]propanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Met Asp Gly Gln

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]acetamido}-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Met Asp Asn Ala

(3S)-3-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Met Asp Gln Gly

(3S)-3-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-{[(1S)-3-carbamoyl-1-[(carboxymethyl)carbamoyl]propyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Met Glu Gly Asn

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-[({[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}methyl)carbamoyl]butanoic acid

C16H27N5O8S (449.158)

Met Glu Asn Gly

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-{[(1S)-2-carbamoyl-1-[(carboxymethyl)carbamoyl]ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Met Gly Asp Gln

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-carboxypropanamido]-4-carbamoylbutanoic acid

C16H27N5O8S (449.158)

Met Gly Glu Asn

(4S)-4-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-4-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Met Gly Gly Trp

(2S)-2-(2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}acetamido)-3-(1H-indol-3-yl)propanoic acid

C20H27N5O5S (449.1733)

Met Gly Asn Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-carbamoylpropanamido]pentanedioic acid

C16H27N5O8S (449.158)

Met Gly Gln Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-4-carbamoylbutanamido]butanedioic acid

C16H27N5O8S (449.158)

Met Gly Trp Gly

2-[(2S)-2-{2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]acetamido}-3-(1H-indol-3-yl)propanamido]acetic acid

C20H27N5O5S (449.1733)

Met Asn Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carbamoylpropanamido]propanamido]butanedioic acid

C16H27N5O8S (449.158)

Met Asn Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carbamoylpropanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Met Asn Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carbamoylpropanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C16H27N5O8S (449.158)

Met Asn Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carbamoylpropanamido]acetamido}pentanedioic acid

C16H27N5O8S (449.158)

Met His Tyr

C20H27N5O5S1 (449.1733)

Met Gln Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carbamoylbutanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C16H27N5O8S (449.158)

Met Gln Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carbamoylbutanamido]acetamido}butanedioic acid

C16H27N5O8S (449.158)

Met Trp Gly Gly

2-{2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(1H-indol-3-yl)propanamido]acetamido}acetic acid

C20H27N5O5S (449.1733)

Asn Ala Asp Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]propanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Asn Ala Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]propanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C16H27N5O8S (449.158)

Asn Cys Asp Val

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C16H27N5O8S (449.158)

Asn Cys Val Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-methylbutanamido]butanedioic acid

C16H27N5O8S (449.158)

Asn Asp Ala Met

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]propanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Asn Asp Cys Val

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]-3-methylbutanoic acid

C16H27N5O8S (449.158)

Asn Asp Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C15H23N5O11 (449.1394)

Asn Asp Met Ala

(3S)-3-[(2S)-2-amino-3-carbamoylpropanamido]-3-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asn Asp Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-hydroxypropanamido]butanedioic acid

C15H23N5O11 (449.1394)

Asn Asp Val Cys

(3S)-3-[(2S)-2-amino-3-carbamoylpropanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-methylpropyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asn Glu Gly Met

(4S)-4-[(2S)-2-amino-3-carbamoylpropanamido]-4-[({[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}methyl)carbamoyl]butanoic acid

C16H27N5O8S (449.158)

Asn Glu Met Gly

(4S)-4-[(2S)-2-amino-3-carbamoylpropanamido]-4-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Asn Gly Glu Met

(4S)-4-{2-[(2S)-2-amino-3-carbamoylpropanamido]acetamido}-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Asn Gly Met Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carbamoylpropanamido]acetamido}-4-(methylsulfanyl)butanamido]pentanedioic acid

C16H27N5O8S (449.158)

Asn Met Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-(methylsulfanyl)butanamido]propanamido]butanedioic acid

C16H27N5O8S (449.158)

Asn Met Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-(methylsulfanyl)butanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Asn Met Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-(methylsulfanyl)butanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C16H27N5O8S (449.158)

Asn Met Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-(methylsulfanyl)butanamido]acetamido}pentanedioic acid

C16H27N5O8S (449.158)

Asn Ser Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-carboxypropanamido]butanedioic acid

C15H23N5O11 (449.1394)

Asn Val Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-methylbutanamido]-3-sulfanylpropanamido]butanedioic acid

C16H27N5O8S (449.158)

Asn Val Asp Cys

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-methylbutanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Pro Cys Cys Gln

(2S)-4-carbamoyl-2-[(2R)-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]butanoic acid

C16H27N5O6S2 (449.1403)

Pro Cys Gln Cys

(2R)-2-[(2S)-4-carbamoyl-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]butanamido]-3-sulfanylpropanoic acid

C16H27N5O6S2 (449.1403)

Trp Met Asn

C20H27N5O5S1 (449.1733)

Pro Gln Cys Cys

(2R)-2-[(2R)-2-[(2S)-4-carbamoyl-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C16H27N5O6S2 (449.1403)

Asn Met Trp

C20H27N5O5S1 (449.1733)

Gln Ala Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]propanamido]-3-sulfanylpropanamido]pentanedioic acid

C16H27N5O8S (449.158)

Gln Ala Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]propanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gln Cys Ala Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-sulfanylpropanamido]propanamido]pentanedioic acid

C16H27N5O8S (449.158)

Gln Cys Cys Pro

(2S)-1-[(2R)-2-[(2R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C16H27N5O6S2 (449.1403)

Gln Cys Glu Ala

(4S)-4-[(2R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gln Cys Pro Cys

(2R)-2-{[(2S)-1-[(2R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C16H27N5O6S2 (449.1403)

Gln Asp Gly Met

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carboxypropanamido]acetamido}-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Gln Asp Met Gly

(3S)-3-[(2S)-2-amino-4-carbamoylbutanamido]-3-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Gln Glu Ala Cys

(4S)-4-[(2S)-2-amino-4-carbamoylbutanamido]-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gln Glu Cys Ala

(4S)-4-[(2S)-2-amino-4-carbamoylbutanamido]-4-{[(1R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C16H27N5O8S (449.158)

Gln Gly Asp Met

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-carbamoylbutanamido]acetamido}-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C16H27N5O8S (449.158)

Gln Gly Met Asp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-carbamoylbutanamido]acetamido}-4-(methylsulfanyl)butanamido]butanedioic acid

C16H27N5O8S (449.158)

Gln Met Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-(methylsulfanyl)butanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C16H27N5O8S (449.158)

Gln Met Gly Asp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-(methylsulfanyl)butanamido]acetamido}butanedioic acid

C16H27N5O8S (449.158)

Gln Pro Cys Cys

(2R)-2-[(2R)-2-{[(2S)-1-[(2S)-2-amino-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C16H27N5O6S2 (449.1403)

Arg Cys Asp Gly

(3S)-3-[(2R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C15H27N7O7S (449.1693)

Arg Cys Gly Asp

(2S)-2-{2-[(2R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]acetamido}butanedioic acid

C15H27N7O7S (449.1693)

Arg Asp Cys Gly

(3S)-3-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Arg Asp Gly Cys

(3S)-3-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-[({[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}methyl)carbamoyl]propanoic acid

C15H27N7O7S (449.1693)

Arg Gly Cys Asp

(2S)-2-[(2R)-2-{2-[(2S)-2-amino-5-carbamimidamidopentanamido]acetamido}-3-sulfanylpropanamido]butanedioic acid

C15H27N7O7S (449.1693)

Arg Gly Asp Cys

(3S)-3-{2-[(2S)-2-amino-5-carbamimidamidopentanamido]acetamido}-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C15H27N7O7S (449.1693)

Trp Asn Met

C20H27N5O5S1 (449.1733)

Met Trp Asn

C20H27N5O5S1 (449.1733)

Ser Asp Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C15H23N5O11 (449.1394)

Ser Asp Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-3-carbamoylpropanamido]butanedioic acid

C15H23N5O11 (449.1394)

Ser Asn Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-carboxypropanamido]butanedioic acid

C15H23N5O11 (449.1394)

His Tyr Met

C20H27N5O5S1 (449.1733)

Asn Trp Met

C20H27N5O5S1 (449.1733)

Val Cys Asp Asn

(3S)-3-[(2R)-2-[(2S)-2-amino-3-methylbutanamido]-3-sulfanylpropanamido]-3-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Val Cys Asn Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-methylbutanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]butanedioic acid

C16H27N5O8S (449.158)

Val Asp Cys Asn

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]-3-carbamoylpropanoic acid

C16H27N5O8S (449.158)

Val Asp Asn Cys

(3S)-3-[(2S)-2-amino-3-methylbutanamido]-3-{[(1S)-2-carbamoyl-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Val Asn Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]butanedioic acid

C16H27N5O8S (449.158)

Val Asn Asp Cys

(3S)-3-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carbamoylpropanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C16H27N5O8S (449.158)

Trp Ala Ala Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]propanamido]propanamido]-3-sulfanylpropanoic acid

C20H27N5O5S (449.1733)

Trp Ala Cys Ala

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]propanamido]-3-sulfanylpropanamido]propanoic acid

C20H27N5O5S (449.1733)

Trp Cys Ala Ala

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanamido]propanamido]propanoic acid

C20H27N5O5S (449.1733)

Trp Gly Gly Met

(2S)-2-(2-{2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]acetamido}acetamido)-4-(methylsulfanyl)butanoic acid

C20H27N5O5S (449.1733)

Trp Gly Met Gly

2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]acetamido}-4-(methylsulfanyl)butanamido]acetic acid

C20H27N5O5S (449.1733)

Trp Met Gly Gly

2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-(methylsulfanyl)butanamido]acetamido}acetic acid

C20H27N5O5S (449.1733)

Crizotinib

C21H22Cl2FN5O (449.1185)

L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors > L01ED - Anaplastic lymphoma kinase (alk) inhibitors C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C164000 - c-Met-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C141136 - ALK Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000970 - Antineoplastic Agents Crizotinib (PF-02341066) is an orally bioavailable, ATP-competitive ALK and c-Met inhibitor with IC50s of 20 and 8 nM, respectively. Crizotinib inhibits tyrosine phosphorylation of NPM-ALK and tyrosine phosphorylation of c-Met with IC50s of 24 and 11 nM in cell-based assays, respectively. Crizotinib is also a ROS1 inhibitor. Crizotinib has effective tumor growth inhibition[1][2][3].

Glisoxepid

N-{2-[4-({[(azepan-1-yl)carbamoyl]amino}sulfonyl)phenyl]ethyl}-5-methyl-1,2-oxazole-3-carboxamide

C20H27N5O5S (449.1733)

A - Alimentary tract and metabolism > A10 - Drugs used in diabetes > A10B - Blood glucose lowering drugs, excl. insulins > A10BB - Sulfonylureas C78276 - Agent Affecting Digestive System or Metabolism > C29711 - Anti-diabetic Agent > C97936 - Sulfonylurea Antidiabetic Agent

Idein

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium

C21H21O11+ (449.1084)

Cyclen

2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium

C21H21O11 (449.1084)

Cyanidin 4'-glucoside

3,5,7-trihydroxy-2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-1$l^{4}-chromen-1-ylium

C21H21O11 (449.1084)

Carnocin CP 5

1-(3-{[(4-acetamidobenzene)sulfonyl]azanidyl}-1,4-dioxo-1,2,3,4-tetrahydronaphthalen-2-yl)-1$l^{5}-pyridin-1-ylium

C23H19N3O5S (449.1045)

Idaein

Cyanidin 3-O-galactoside

C21H21O11+ (449.1084)

Chrysanthemin

cyanidin 3-O-glucoside

C21H21O11 (449.1084)

Noscapine hydrochloride

C22H24ClNO7 (449.1241)

(5R-cis)-Toluene-4-sulfonic acid 5-(2,4-difluorophenyl)-5-(1H-1,2,4-triazol-1-yl)methyltetrahydrofuran-3-ylmethyl ester

C21H21F2N3O4S (449.1221)

Sarmoxicillin

METHOXYMETHYL 7-[4-(4-HYDROXYPHENYL)-2,2-DIMETHYL-5-OXO-IMIDAZOLIDIN-1-YL]-3,3-DIMETHYL-6-OXO-2-THIA-5-AZABICYCLO[3.2.0]HEPTANE-4-CARBOXYLATE

C21H27N3O6S (449.162)

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

hydrocodone bitartrate

C22H27NO9 (449.1686)

H-Arg-Gly-Asp-Cys-OH trifluoroacetate salt

C15H27N7O7S (449.1693)

Tubastatin A

C22H22F3N3O4 (449.1562)

Methyl3,4,6-tri-O-acetyl-2-deoxy-2-phthalimido-b-D-glucopyranoside

C21H23NO10 (449.1322)

benzyl (2R)-3-(4-methylphenyl)sulfonyloxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

C22H27NO7S (449.1508)

Pyrrolo[1,2-a]pyrazine-3-acetic acid, 7-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]octahydro-1,4-dioxo-, (3S,7S,8aS)- (9CI)

C24H23N3O6 (449.1587)

Vat Green 3

C31H15NO3 (449.1052)

sodium 4-(2H-naphtho[1,2-d]triazol-2-yl)stilbene-2-sulphonate

C24H16N3NaO3S (449.081)

(S)-Crizotinib

C21H22Cl2FN5O (449.1185)

1-(2-aminoethyl)-3-(3,6-dihydroxy-3-oxospiro[2-benzofuran-1,9-xanthene]-5-yl)thiourea

C23H19N3O5S (449.1045)

KC 12291 hydrochloride

C22H28ClN3O3S (449.154)

Posaconazole Impurity 9

C21H21F2N3O4S (449.1221)

2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-erythro-pentitol

C21H21F2N3O4S (449.1221)

Bictegravir

C21H18F3N3O5 (449.1198)

C254 - Anti-Infective Agent > C281 - Antiviral Agent > C1660 - Anti-HIV Agent

Asciminib

C20H18ClF2N5O3 (449.1066)

L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors > L01EA - Bcr-abl tyrosine kinase inhibitors C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor

B-spiro[9H-fluorene-9,8-indolo[3,2,1-de]acridin]-2-yl-Boronic acid

C31H20BNO2 (449.1587)

B-spiro[9H-Fluorene-9,8-indolo[3,2,1-de]acridin]-3-ylboronic acid

C31H20BNO2 (449.1587)

B-spiro[9H-Fluorene-9,8-indolo[3,2,1-de]acridin]-4-ylboronic acid

C31H20BNO2 (449.1587)

M2698 free base

C21H19ClF3N5O (449.123)

C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C155764 - AKT Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor M2698 (MSC2363318A) is an orally active, ATP competitive, selective p70S6K and Akt dual-inhibitor with IC50s of 1 nM for p70S6K, Akt1 and Akt3. M2698 can cross the blood-brain barrier and has anti-cancer activity[1].

Brilaroxazine

C22H25Cl2N3O3 (449.1273)

C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent Brilaroxazine (RP5603) is a potent and orally active multimodal dopamine (DA)/serotonin (5-HT) modulator. Brilaroxazine is a partial agonist of dopamine (DA) D2, D3, and D4?receptors, 5-HT1A (Ki=1.5 nM)?and 5-HT2A (Ki=2.5 nM), and has antagonist activity at 5-HT2B (Ki=0.19 nM), and 5-HT7 (Ki=2.7 nM) receptors[1]. Brilaroxazine is an atypical antipsychotic agent, and has the potential to improve cognitive impairments in neuropsychiatric and neurological diseases in vivo[2].

N-{4-Methyl-3-[(3-Pyrimidin-4-Ylpyridin-2-Yl)amino]phenyl}-3-(Trifluoromethyl)benzamide

C24H18F3N5O (449.1463)

MobileTrex

C23H23N5O5 (449.1699)

Mevidalen

C24H29Cl2NO3 (449.1524)

C26170 - Protective Agent > C1509 - Neuroprotective Agent LY3154207 is a potent, subtype selective, and orally available human dopamine D1 receptor positive allosteric modulator (PAM) with minimal allosteric agonist activity (EC50=3 nM)[1].

Coelenterazine e

C28H23N3O3 (449.1739)

N-(3,5-dimethylphenyl)-2-[[4-(4-fluorophenyl)-5-[(1-methyl-2-pyrrolyl)methyl]-1,2,4-triazol-3-yl]thio]acetamide

C24H24FN5OS (449.1686)

N-(9,9-dimethyl-7-oxo-8,10-dihydronaphtho[1,2-b]benzofuran-5-yl)-4-methoxybenzenesulfonamide

C25H23NO5S (449.1297)

N-[[3-(4-nitrophenyl)sulfonyl-2-oxazolidinyl]methyl]-N-(2-pyridinylmethyl)oxamide

C18H19N5O7S (449.1005)

1-bromo-3-(5,5-dimethyl-3-phenyl-4H-pyrazolo[4,3-a]carbazol-10-yl)-2-propanol

C24H24BrN3O (449.1103)

Petunidin 3-arabinoside cation

C21H21O11+ (449.1084)

1-{[(3R)-3-methyl-4-({4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]phenyl}sulfonyl)piperazin-1-yl]methyl}cyclopropanecarboxamide

C19H26F3N3O4S (449.1596)

2-(5-Chloro-2-Thienyl)-N-{(3s)-1-[(1s)-1-Methyl-2-Morpholin-4-Yl-2-Oxoethyl]-2-Oxopyrrolidin-3-Yl}ethanesulfonamide

C17H24ClN3O5S2 (449.0846)

N-cyclopropyl-3-{[1-(2,4-difluorophenyl)-7-methyl-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]amino}-4-methylbenzamide

C24H21F2N5O2 (449.1663)

5-O-(N-(L-Cysteinyl)-sulfamoyl)adenosine

C13H19N7O7S2 (449.0787)

N-Hydroxy-1-(4-methoxyphenyl)sulfonyl-4-benzyloxycarbonyl-piperazine-2-carboxamide

C20H23N3O7S (449.1257)

1-(5-Carboxypentyl)-5-[(2,6-dichlorobenzyl)oxy]-1 H-indole-2-carboxylic acid

C22H21Cl2NO5 (449.0797)

4-Nitrophenyl-(6-S-alpha-D-xylopyranosyl)-beta-D-glucopyranoside

C17H23NO11S (449.0992)

Cyanidin 3-glucoside

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1lambda4-chromen-1-ylium

C21H21O11+ (449.1084)

Cyanidin 3-glucoside, also known as chrysanthenin or cyanidin 3-glucoside chloride (CAS: 7084-24-4), belongs to the class of organic compounds known as pyranones and derivatives. Pyranones and derivatives are compounds containing a pyran ring which bears a ketone. Cyanidin 3-glucoside is an extremely weak basic (essentially neutral) compound (based on its pKa). Outside of the human body, cyanidin 3-glucoside is found, on average, in the highest concentration within a few different foods, such as black elderberries, rubus (blackberry, raspberry), and bilberries and in a lower concentration in redcurrants, strawberries, and sweet oranges. Cyanidin 3-glucoside has also been detected, but not quantified in, several different foods, such as common pea, peaches, Tartary buckwheats, soft-necked garlic, and fats and oils. This could make cyanidin 3-glucoside a potential biomarker for the consumption of these foods. Cyanidin (and its glycosides) is the most commonly occurring of the anthocyanins, a widespread group of pigments responsible for the red-blue colour of many fruits and vegetables (PMID: 14711454). BioTransformer predicts that cyanidin 3-glucoside is a product of cyanidin 3-sophoroside metabolism via a glycoside-hydrolysis reaction occurring in human gut microbiota and catalyzed by the EC.3.2.1.X enzyme (PMID: 30612223). Found in many plants and fruits, e.g. cherries, olives and grapes

Cyanidin 3-O-alpha-L-galactoside

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C21H21O11+ (449.1084)

6-C-glucosyl-2-hydroxynaringenin

C21H21O11- (449.1084)

3-C-glucosyl-2,4,4,6-tetrahydroxydibenzoylmethane

C21H21O11- (449.1084)

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-7-methylsulfanyl-N-sulfooxyheptanimidothioate

C14H27NO9S3 (449.0848)

(2R,3S,4R,5S,6S)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

C21H21O11+ (449.1084)

2-[[5-[2-(2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-6-yl)ethyl]thiophene-2-carbonyl]amino]pentanedioic acid

C19H23N5O6S (449.1369)

Commodore

C23H19ClF3NO3 (449.1005)

[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-7-methylsulfanyl-N-sulfooxyheptanimidothioate

C14H27NO9S3 (449.0848)

N-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-2-furancarboxamide

C23H20ClN5O3 (449.1255)

(2S)-3-methyl-2-[[(3-methylphenyl)-oxomethyl]amino]butanoic acid (4-oxo-2-pyrimido[2,1-b][1,3]benzothiazolyl)methyl ester

C24H23N3O4S (449.1409)

2-[[[3-Methyl-4-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]benzoic acid

C23H19N3O7 (449.1223)

ethyl 5-bromo-3-[3-(3,3-dimethylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate

C21H28BrN3O3 (449.1314)

(E)-2-(benzenesulfonyl)-3-[9-methyl-2-(4-methylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile

C23H23N5O3S (449.1522)

5-[[5-Benzyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-thiophen-2-yl-1,2,4-oxadiazole

C22H16FN5OS2 (449.078)

N-[2-(2,5-dimethoxyphenyl)-1-({2-[(5-methyl-2-thienyl)methylene]hydrazino}carbonyl)vinyl]benzamide

C24H23N3O4S (449.1409)

2,3,4,4,6-pentahydroxychalcone 4-O-beta-D-glucoside(1-)

C21H21O11- (449.1084)

2-(2-Furanylmethylamino)benzoic acid [2-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl] ester

C24H23N3O4S (449.1409)

2-(2-Methoxyanilino)-8-[(3-methyl-1-piperidinyl)-oxomethyl]-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

C23H23N5O3S (449.1522)

4-[4-(4-Methylphenyl)sulfonyl-1-piperidinyl]-2-thiophen-2-ylquinazoline

C24H23N3O2S2 (449.1232)

7-methoxycrinamabine Trifluoroacetic acid

C19H22F3NO8 (449.1297)

A natural product found in Crinum asiaticum var. sinicum.

Cyanidin 5-O-glucoside

C21H21O11+ (449.1084)

(2S,3S,3aR,9bR)-7-(2-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1-(pyridin-4-ylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester

C25H24FN3O4 (449.1751)

methyl (2S,3S,3aR,9bR)-1-[(3-fluorophenyl)methyl]-3-(hydroxymethyl)-6-oxo-7-pyridin-3-yl-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylate

C25H24FN3O4 (449.1751)

(1R,9S,10S,11S)-5-(2-fluorophenyl)-10-(hydroxymethyl)-6-oxo-12-(pyridine-3-carbonyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylic acid

C24H20FN3O5 (449.1387)

(2S,3S,3aR,9bR)-7-(3-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1-(pyridine-2-carbonyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid

C24H20FN3O5 (449.1387)

methyl (1R,9S,10S,11S)-5-(4-fluorophenyl)-10-(hydroxymethyl)-6-oxo-12-(pyridin-3-ylmethyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylate

C25H24FN3O4 (449.1751)

2-[(2R,5S,6R)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

2-[(2S,5S,6R)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

N-[(2S,3R,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

N-[(2R,3S,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

N-[(2S,3S,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

(2R,3R,3aS,9bS)-7-(3-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1-[oxo(2-pyridinyl)methyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid

C24H20FN3O5 (449.1387)

methyl (1S,9R,10R,11R)-5-(4-fluorophenyl)-10-(hydroxymethyl)-6-oxo-12-(pyridin-3-ylmethyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylate

C25H24FN3O4 (449.1751)

2-[(2S,5R,6S)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

2-[(2R,5R,6S)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

2-[(2S,5S,6S)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

2-[(2R,5R,6R)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

2-[(2R,5S,6S)-6-(hydroxymethyl)-5-[(3-methoxyphenyl)sulfonylamino]-2-oxanyl]-N-(pyridin-4-ylmethyl)acetamide

C21H27N3O6S (449.162)

N-[(2R,3S,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

N-[(2S,3R,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

N-[(2S,3S,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

N-[(2R,3R,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]-3-pyridinecarboxamide

C21H21Cl2N3O4 (449.0909)

2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(4-methoxyphenyl)sulfonylamino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid

C21H23NO8S (449.1144)

(1S,9R,10R,11R)-5-(2-fluorophenyl)-10-(hydroxymethyl)-6-oxo-12-(pyridine-3-carbonyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxylic acid

C24H20FN3O5 (449.1387)

(2R,3R,3aS,9bS)-7-(2-fluorophenyl)-3-(hydroxymethyl)-6-oxo-1-(pyridin-4-ylmethyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester

C25H24FN3O4 (449.1751)

(2R,3R,3aS,9bS)-1-[(3-fluorophenyl)methyl]-3-(hydroxymethyl)-6-oxo-7-(3-pyridinyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxylic acid methyl ester

C25H24FN3O4 (449.1751)

Asn-Met-Trp

C20H27N5O5S (449.1733)

Asn-Trp-Met

C20H27N5O5S (449.1733)

Met-Trp-Asn

C20H27N5O5S (449.1733)

Met-Tyr-His

C20H27N5O5S (449.1733)

Tyr-Met-His

C20H27N5O5S (449.1733)

Trp-Met-Asn

C20H27N5O5S (449.1733)

His-Met-Tyr

C20H27N5O5S (449.1733)

His-Tyr-Met

C20H27N5O5S (449.1733)

Met-Asn-Trp

C20H27N5O5S (449.1733)

Met-His-Tyr

C20H27N5O5S (449.1733)

Trp-Asn-Met

C20H27N5O5S (449.1733)

Tyr-His-Met

C20H27N5O5S (449.1733)

beta-D-Galp-(1->4)-beta-D-Glcp-SC6H4-p-NH2

C18H27NO10S (449.1356)

(2E)-2-[[3-methoxy-4-(3-methylbutoxy)phenyl]methylidene]-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

C24H23N3O4S (449.1409)

(2S,3S,4S,5R)-3,4,5-trihydroxy-6-[2-hydroxy-5-(4-methylbenzoyl)-3-nitrophenoxy]oxane-2-carboxylic acid

C20H19NO11 (449.0958)

Ethyl 4,7-DI(para-ethoxyphenyl)-1,2,5-thiadiazolo(3,4-C)pyridine-6-carboxylate

C24H23N3O4S (449.1409)

Kuromanin

C21H21O11+ (449.1084)

Cyanidin 3-O-galactoside

Cyanidin 3-O-beta-D-galactoside

C21H21O11+ (449.1084)

An anthocyanin cation that is cyanidin(1+) carrying a single beta-D-galactosyl substituent at position 3.

Cyanidin 7-glucoside

C21H21O11+ (449.1084)

Cyanidin 4-glucoside

C21H21O11+ (449.1084)

λ-Cyhalothrin

Cyclopropanecarboxylicacid, 3-[(1Z)-2-chloro-3,3,3-trifluoro-1-propen-1-yl]-2,2-dimethyl-,(S)-cyano(3-phenoxyphenyl)methyl ester, (1R,3R)-

C23H19ClF3NO3 (449.1005)

D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals

2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

C21H21O11+ (449.1084)

cyanidin 3-O-beta-D-glucoside

C21H21O11 (449.1084)

An anthocyanin cation that is a cyanidin cation linked to a beta-D-glucosyl moiety at position 3.

ST 20:5;O7;Gly

C22H27NO9 (449.1686)

MK8722

C24H20ClN3O4 (449.1142)

MK8722 is a potent and systemic pan-AMPK activator.

OPC-14523 (hydrochloride)

C23H29Cl2N3O2 (449.1637)

OPC-14523 hydrochloride is an orally active sigma and 5-HT1A receptor agonist, with high affinity for sigma receptors (σ1/2 IC50=47/56 nM), the 5-HT1A receptor (IC50=2.3 nM), and the 5-HT transporter (IC50=80 nM). OPC-14523 hydrochloride shows antidepressant-like activity[1][2].