Exact Mass: 507.1449

Exact Mass Matches: 507.1449

Found 220 metabolites which its exact mass value is equals to given mass value 507.1449, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

POLYOXIN B

2-[(2-amino-5-carbamoyloxy-3,4-dihydroxy-pentanoyl)amino]-2-[(2R,3S,4R,5R)-3,4-dihydroxy-5-[5-(hydroxymethyl)-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]acetic acid

C17H25N5O13 (507.1449)

Glucoarabin

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-10-methylsulfinyl-N-sulfooxydecanimidothioate

C17H33NO10S3 (507.1267)

Glucoarabin is a glucosinolic acid and a sulfoxide.

Delphinidin 3-(acetylglucoside)

3-{[(2S,3R,4S,5S,6R)-6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

C23H23O13+ (507.1139)

Isolated from grapes. Delphinidin 3-(acetylglucoside) is found in many foods, some of which are summer grape, common grape, fruits, and highbush blueberry. Delphinidin 3-(acetylglucoside) is found in common grape. Delphinidin 3-(acetylglucoside) is isolated from grapes.

2-Decarboxybetanin

(1Z)-1-{2-[(4E)-2,6-dicarboxy-1,2,3,4-tetrahydropyridin-4-ylidene]ethylidene}-6-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1H-1λ⁵-indol-1-ylium

C23H27N2O11+ (507.1615)

2-Decarboxybetanin is found in root vegetables. 2-Decarboxybetanin is a constituent of Beta vulgaris Constituent of Beta vulgaris. 2-Decarboxybetanin is found in root vegetables.

Benzamide, 5-((1,5-bis(4-methoxyphenyl)-1H-pyrazol-3-yl)dimethoxymethyl)-2-chloro-

C27H26ClN3O5 (507.1561)

Delphinidin 3-(6'-acetylgalactoside)

3-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

C23H23O13 (507.1139)

Delphinidin 3-(6"-acetylgalactoside) 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-(6"-acetylgalactoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Delphinidin 3-(6"-acetylgalactoside) can be found in highbush blueberry and lowbush blueberry, which makes delphinidin 3-(6"-acetylgalactoside) a potential biomarker for the consumption of these food products. Delphinidin 3-(6-acetylgalactoside) 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-(6"-acetylgalactoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Delphinidin 3-(6"-acetylgalactoside) can be found in highbush blueberry and lowbush blueberry

Delphinidin 3-(6-O-acetylgalactoside)

3,5,7,3,4,5-Hexahydroxyflavylium 3- (6-O-acetylgalactoside)

C23H23O13 (507.1139)

Hirsutidin 3-glucoside

C24H27O12 (507.1502)

Delphinidin 3-(6-acetylglucoside)

2- (3,4,5-Trihydroxyphenyl) -3- [ (6-O-acetyl-beta-D-glucopyranosyl) oxy ] -5,7-dihydroxy-1-benzopyrylium

C23H23O13 (507.1139)

(2E)-3-[2,3-dihydro-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-1,4-benzodioxin-6-yl]-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide|thoreliamide B

C28H29NO8 (507.1893)

C28H29NO8

C28H29NO8 (507.1893)

Naamidine F

C25H25N5O7 (507.1754)

hygrocin G

C28H29NO8 (507.1893)

C24H29NO11

C24H29NO11 (507.1741)

(1S,3aS)-jadomycin Ala

C27H25NO9 (507.1529)

Ala Cys Glu Trp

(4S)-4-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Ala Cys Trp Glu

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

C22H29N5O7S (507.1788)

Ala Glu Cys Trp

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1R)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Ala Glu Trp Cys

(4S)-4-[(2S)-2-aminopropanamido]-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Ala Trp Cys Glu

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

C22H29N5O7S (507.1788)

Ala Trp Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-indol-3-yl)propanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Cys Ala Glu Trp

(4S)-4-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-4-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Cys Ala Trp Glu

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

C22H29N5O7S (507.1788)

Cys Cys Pro Trp

(2S)-2-{[(2S)-1-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(1H-indol-3-yl)propanoic acid

C22H29N5O5S2 (507.161)

Cys Cys Trp Pro

(2S)-1-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxylic acid

C22H29N5O5S2 (507.161)

Cys Asp Asp Arg

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

C17H29N7O9S (507.1747)

Cys Asp Arg Asp

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

C17H29N7O9S (507.1747)

Cys Glu Ala Trp

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Cys Glu Glu Gln

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

C18H29N5O10S (507.1635)

Cys Glu Gln Glu

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

C18H29N5O10S (507.1635)

Cys Glu Trp Ala

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Cys Pro Cys Trp

(2S)-2-[(2R)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanoic acid

C22H29N5O5S2 (507.161)

Cys Pro Trp Cys

(2R)-2-[(2S)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanoic acid

C22H29N5O5S2 (507.161)

Cys Gln Glu Glu

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

C18H29N5O10S (507.1635)

Cys Arg Asp Asp

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

C17H29N7O9S (507.1747)

Cys Trp Ala Glu

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

C22H29N5O7S (507.1788)

Cys Trp Cys Pro

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

C22H29N5O5S2 (507.161)

Cys Trp Glu Ala

(4S)-4-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Cys Trp Pro Cys

(2R)-2-{[(2S)-1-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-indol-3-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C22H29N5O5S2 (507.161)

Asp Cys Asp Arg

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

C17H29N7O9S (507.1747)

Asp Cys Arg Asp

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

C17H29N7O9S (507.1747)

Asp Asp Cys Arg

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

C17H29N7O9S (507.1747)

Asp Asp Met Gln

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

C18H29N5O10S (507.1635)

Asp Asp Gln Met

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

C18H29N5O10S (507.1635)

Asp Asp Arg Cys

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

C17H29N7O9S (507.1747)

Asp Glu Met Asn

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

C18H29N5O10S (507.1635)

Asp Glu Asn Met

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

C18H29N5O10S (507.1635)

Asp Gly Met Trp

(3S)-3-amino-3-[({[(1S)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}methyl)carbamoyl]propanoic acid

C22H29N5O7S (507.1788)

Asp Gly Trp Met

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

C22H29N5O7S (507.1788)

Asp Met Asp Gln

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

C18H29N5O10S (507.1635)

Asp Met Glu Asn

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

C18H29N5O10S (507.1635)

Asp Met Gly Trp

(3S)-3-amino-3-{[(1S)-1-[({[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}methyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H29N5O7S (507.1788)

Asp Met Asn Glu

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

C18H29N5O10S (507.1635)

Asp Met Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-4-carbamoylbutanamido]butanedioic acid

C18H29N5O10S (507.1635)

Asp Met Trp Gly

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-(1H-indol-3-yl)ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H29N5O7S (507.1788)

Asp Asn Glu Met

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

C18H29N5O10S (507.1635)

Asp Asn Met Glu

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

C18H29N5O10S (507.1635)

Asp Gln Asp Met

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

C18H29N5O10S (507.1635)

Asp Gln Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carbamoylbutanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C18H29N5O10S (507.1635)

Asp Arg Cys Asp

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

C17H29N7O9S (507.1747)

Asp Arg Asp Cys

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

C17H29N7O9S (507.1747)

Asp Trp Gly Met

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

C22H29N5O7S (507.1788)

Asp Trp Met Gly

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}propanoic acid

C22H29N5O7S (507.1788)

Glu Ala Cys Trp

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

C22H29N5O7S (507.1788)

Glu Ala Trp Cys

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

C22H29N5O7S (507.1788)

Glu Cys Ala Trp

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

C22H29N5O7S (507.1788)

Glu Cys Glu Gln

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

C18H29N5O10S (507.1635)

Glu Cys Gln Glu

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

C18H29N5O10S (507.1635)

Glu Cys Trp Ala

(4S)-4-amino-4-{[(1R)-1-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Glu Asp Met Asn

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

C18H29N5O10S (507.1635)

Glu Asp Asn Met

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

C18H29N5O10S (507.1635)

Glu Glu Cys Gln

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

C18H29N5O10S (507.1635)

Glu Glu Gln Cys

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

C18H29N5O10S (507.1635)

Glu Met Asp Asn

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

C18H29N5O10S (507.1635)

Glu Met Asn Asp

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

C18H29N5O10S (507.1635)

Glu Asn Asp Met

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

C18H29N5O10S (507.1635)

Glu Asn Met Asp

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

C18H29N5O10S (507.1635)

Glu Gln Cys Glu

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

C18H29N5O10S (507.1635)

Glu Gln Glu Cys

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

C18H29N5O10S (507.1635)

Glu Trp Ala Cys

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

C22H29N5O7S (507.1788)

Glu Trp Cys Ala

(4S)-4-amino-4-{[(1S)-1-{[(1R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Gly Asp Met Trp

(3S)-3-(2-aminoacetamido)-3-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H29N5O7S (507.1788)

Gly Asp Trp Met

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

C22H29N5O7S (507.1788)

Gly Met Asp Trp

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

C22H29N5O7S (507.1788)

Gly Met Trp Asp

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

C22H29N5O7S (507.1788)

Gly Trp Asp Met

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

C22H29N5O7S (507.1788)

Gly Trp Met Asp

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

C22H29N5O7S (507.1788)

b-D-Glucopyranosiduronic acid, 4-[[4-(4-fluorophenyl)-3-piperidinyl]methoxy]-2-methoxyphenyl, (3S-tr

C25H30FNO9 (507.1905)

5-[[4-(4-fluorophenyl)-3-piperidinyl]methoxy]-2-methoxy-, (3S-trans)-Phenol glucuronide

C25H30FNO9 (507.1905)

Met Asp Asp Gln

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

C18H29N5O10S (507.1635)

Met Asp Glu Asn

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

C18H29N5O10S (507.1635)

Met Asp Gly Trp

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

C22H29N5O7S (507.1788)

Met Asp Asn Glu

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

C18H29N5O10S (507.1635)

Met Asp Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-4-carbamoylbutanamido]butanedioic acid

C18H29N5O10S (507.1635)

Met Asp Trp Gly

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

C22H29N5O7S (507.1788)

Met Glu Asp Asn

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

C18H29N5O10S (507.1635)

Met Glu Asn Asp

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

C18H29N5O10S (507.1635)

Met Gly Asp Trp

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

C22H29N5O7S (507.1788)

Met Gly Trp Asp

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

C22H29N5O7S (507.1788)

Met Asn Asp Glu

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

C18H29N5O10S (507.1635)

Met Asn Glu Asp

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

C18H29N5O10S (507.1635)

Met Gln Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carbamoylbutanamido]-3-carboxypropanamido]butanedioic acid

C18H29N5O10S (507.1635)

Met Trp Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(1H-indol-3-yl)propanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C22H29N5O7S (507.1788)

Met Trp Gly Asp

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

C22H29N5O7S (507.1788)

Asn Asp Glu Met

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

C18H29N5O10S (507.1635)

Asn Asp Met Glu

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

C18H29N5O10S (507.1635)

Asn Glu Asp Met

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

C18H29N5O10S (507.1635)

Asn Glu Met Asp

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

C18H29N5O10S (507.1635)

Asn Met Asp Glu

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

C18H29N5O10S (507.1635)

Asn Met Glu Asp

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

C18H29N5O10S (507.1635)

Pro Cys Cys Trp

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

C22H29N5O5S2 (507.161)

Pro Cys Trp Cys

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

C22H29N5O5S2 (507.161)

Pro Trp Cys Cys

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

C22H29N5O5S2 (507.161)

Gln Cys Glu Glu

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

C18H29N5O10S (507.1635)

Gln Asp Asp Met

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

C18H29N5O10S (507.1635)

Gln Asp Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C18H29N5O10S (507.1635)

Gln Glu Cys Glu

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

C18H29N5O10S (507.1635)

Gln Glu Glu Cys

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

C18H29N5O10S (507.1635)

Gln Met Asp Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]butanedioic acid

C18H29N5O10S (507.1635)

Arg Cys Asp Asp

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

C17H29N7O9S (507.1747)

Arg Asp Cys Asp

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

C17H29N7O9S (507.1747)

Arg Asp Asp Cys

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

C17H29N7O9S (507.1747)

Trp Ala Cys Glu

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

C22H29N5O7S (507.1788)

Trp Ala Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]propanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Trp Cys Ala Glu

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

C22H29N5O7S (507.1788)

Trp Cys Cys Pro

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

C22H29N5O5S2 (507.161)

Trp Cys Glu Ala

(4S)-4-[(2R)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Trp Cys Pro Cys

(2R)-2-{[(2S)-1-[(2R)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C22H29N5O5S2 (507.161)

Trp Asp Gly Met

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

C22H29N5O7S (507.1788)

Trp Asp Met Gly

(3S)-3-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-{[(1S)-1-[(carboxymethyl)carbamoyl]-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H29N5O7S (507.1788)

Trp Glu Ala Cys

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

C22H29N5O7S (507.1788)

Trp Glu Cys Ala

(4S)-4-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-{[(1R)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}butanoic acid

C22H29N5O7S (507.1788)

Trp Gly Asp Met

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

C22H29N5O7S (507.1788)

Trp Gly Met Asp

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

C22H29N5O7S (507.1788)

Trp Met Asp Gly

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-(methylsulfanyl)butanamido]-3-[(carboxymethyl)carbamoyl]propanoic acid

C22H29N5O7S (507.1788)

Trp Met Gly Asp

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

C22H29N5O7S (507.1788)

Trp Pro Cys Cys

(2R)-2-[(2R)-2-{[(2S)-1-[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C22H29N5O5S2 (507.161)

Trp-Phe4Cl-OH

(S)-2-(3-(2-(1H-indol-2-yl)ethoxy)-4-nitrobenzamido)-3-(4-chlorophenyl)propanoic acid

C26H22ClN3O6 (507.1197)

2-Decarboxybetanin

(1E)-1-{2-[(4E)-2,6-dicarboxy-1,2,3,4-tetrahydropyridin-4-ylidene]ethylidene}-6-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1H-1$l^{5}-indol-1-ylium

C23H27N2O11 (507.1615)

Delphinidin 3-(acetylglucoside)

3-{[(2S,3R,4S,5S,6R)-6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1$l^{4}-chromen-1-ylium

C23H23O13 (507.1139)

Hirsutidin 3-glucoside

C24H27O12+ (507.1502)

PF-562271

PF-00562271 free base

C21H20F3N7O3S (507.13)

Quinacrine Dihydrochloride Dihydrate

C23H36Cl3N3O3 (507.1822)

Dibutyryl-cGMP sodium

C18H23N5NaO9P (507.1131)

Dibutyryl-cGMP sodium (Bt2cGMP sodium) is a cell-permeable cGMP analogue. Dibutyryl-cGMP sodium preferentially activates cGMP-dependent protein kinase (PKG). Dibutyryl-cGMP sodium inhibits the release of [3H]-arachidonic acid from γ thrombin-stimulated human platelets. Dibutyryl-cGMP sodium induces peripheral antinociception via activation of ATP-sensitive K+ channels[1][2][3].

(S,E)-ETHYL 7-(4-(4-FLUOROPHENYL)-6-ISOPROPYL-2-(N-METHYLMETHYLSULFONAMIDO)PYRIMIDIN-5-YL)-5-HYDROXY-3-OXOHEPT-6-ENOATE

C24H30FN3O6S (507.1839)

2-[(1E,3Z)-3-CYANO-5-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)-1,3-PENTADIENYL]-1,3,3-TRIMETHYL-3H-INDOLIUM PERCHLORATE

C28H30ClN3O4 (507.1925)

CLEBOPRIDE malATE

Clebopride (malate)

C24H30ClN3O7 (507.1772)

C78272 - Agent Affecting Nervous System > C66883 - Dopamine Antagonist Clebopride malate is a dopamine antagonist used in the study of functional gastrointestinal disorders.

Benzenesulfonamide, N-[1,6-dihydro-5-(2-Methoxyphenoxy)-6-oxo[2,2-bipyrimidin]-4-yl]-4-(1,1-dimethylethyl)-

C25H25N5O5S (507.1576)

1,3,5-tris[3-(pyridin-4-yl)-1H-pyrazol-1-yl]benzene

C30H21N9 (507.192)

SRT 1460

C26H29N5O4S (507.194)

SRT 1460, a potent Sirtuin-1 (SIRT1) activator with an EC1.5 value of 2.9 μM, shows good selectivity for activation of SIRT1 versus SIRT2 and SIRT3 (EC1.5>300 μM), and is more potent than Resveratrol and the closest sirtuin homologues[1].

Umeclidinium Bromide

Umeclidinium (bromide)

C29H34BrNO2 (507.1773)

R - Respiratory system > R03 - Drugs for obstructive airway diseases > R03B - Other drugs for obstructive airway diseases, inhalants > R03BB - Anticholinergics C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent Umeclidinium bromide is a novel mAChR antagonist. The affinity (Ki) of Umeclidinium bromide for the cloned human M1-M5 mAChRs ranges from 0.05 to 0.16 nM.

2-[[[2-Amino-1-(3-methoxypropyl)-3-pyrrolo[3,2-b]quinoxalinyl]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester

C26H29N5O4S (507.194)

N-alpha-(2-Naphthylsulfonyl)-N(3-amidino-L-phenylalaninyl)-4-acetyl-piperazine

C26H29N5O4S (507.194)

(E)-1-(glutathion-S-yl)-N-hydroxy-omega-(methylsulfanyl)nonan-1-imine

C20H35N4O7S2- (507.1947)

(1R,2R,5S,8S,9S,10R,11R,12S)-5-hydroxy-11-methyl-6-methylidene-16-oxo-12-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylate

(1R,2R,5S,8S,9S,10R,11R,12S)-5-hydroxy-11-methyl-6-methylidene-16-oxo-12-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylate

C25H31O11- (507.1866)

Delphinidin 3-(6-acetylgalactoside)

C23H23O13+ (507.1139)

Lonijaposide G

C24H29NO11 (507.1741)

A natural product found in Lonicera japonica.

Lonijaposide F

C24H29NO11 (507.1741)

A natural product found in Lonicera japonica.

Lonijaposide L

C24H29NO11 (507.1741)

A natural product found in Lonicera japonica.

2-[1-[(4-chlorophenyl)-oxomethyl]-5-methoxy-2-methyl-3-indolyl]-N-[(2-hydroxy-5-nitrophenyl)methyl]acetamide

C26H22ClN3O6 (507.1197)

gibberellin A3 O-beta-D-glucoside(1-)

C25H31O11- (507.1866)

6-(2,6-dichlorophenyl)-2-[4-(morpholin-4-yl)anilino]imidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-one

C24H19Cl2N7O2 (507.0977)

N-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-thiophenesulfonamide

C24H33N3O5S2 (507.1862)

N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-thiophenesulfonamide

C24H33N3O5S2 (507.1862)

N-[(2R,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-thiophenesulfonamide

C24H33N3O5S2 (507.1862)

(1R)-N-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(2-thiazolylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

C26H26FN5O3S (507.174)

N-[(2R,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-2-thiophenesulfonamide

C24H33N3O5S2 (507.1862)

N-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-thiophenesulfonamide

C24H33N3O5S2 (507.1862)

N-[(2S,3R)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2-thiophenesulfonamide

C24H33N3O5S2 (507.1862)

5-chloro-N-[(2R)-2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]propyl]-2-methoxybenzamide

C24H30ClN3O5S (507.1595)

Delphinidin 3-(acetylglucoside)

C23H23O13+ (507.1139)

2-Decarboxybetanin

C23H27N2O11+ (507.1615)

delphinidin 3-O-(6-O-acetyl-beta-D-glucoside)

C23H23O13 (507.1139)

An anthocyanin cation that is delphinidin substituted at position 3 by a 6-O-acetyl-beta-D-glucosyl residue.

ST 23:6;O5;Tau

C25H33NO8S (507.1927)

(E/Z)-Sivopixant

C25H22ClN5O5 (507.1309)

(E/Z)-Sivopixant ((E/Z)-S-600918) is a potent P2X3 receptor antagonist with an IC50 of 4 nM. (E/Z)-Sivopixant can be used for respiratory diseases research[1].

Elcubragistat

C20H22F9N3O2 (507.1568)

Elcubragistat (ABX-1431) is a highly potent, selective, and orally available, CNS-penetrant monoacylglycerol lipase (MAGL) inhibitor with an IC50 of 14 nM.

Ibiglustat (succinate)

C24H30FN3O6S (507.1839)

Ibiglustat (Venglustat) succinate is an orally active, brain-penetrant glucosylceramide synthase (GCS) inhibitor. Ibiglustat succinate can be used for the research of Gaucher disease type 3, Parkinson's disease associated with GBA mutations, Fabry disease, GM2 gangliosidosis, and autosomal dominant polycystic kidney disease[1][2].

n-[(2r,3r,4r,6r)-6-{[(3s)-3-ethyl-6-hydroxy-1,7,12-trioxo-3,4-dihydro-2h-tetraphen-8-yl]oxy}-3-hydroxy-2-methyloxan-4-yl]ethanimidic acid

C28H29NO8 (507.1893)

(3s)-5-chloro-8-hydroxy-3-methyl-1-oxo-n-[(2r)-1-oxo-3-phenyl-1-(2,3,4-trihydroxybutoxy)propan-2-yl]-3,4-dihydro-2-benzopyran-7-carboximidic acid

C24H26ClNO9 (507.1296)

(12r,15s)-9-ethyl-4,18-dihydroxy-12-(1-hydroxyethyl)-3,15-dimethyl-13-oxa-19-azatetracyclo[18.3.1.0⁵,²³.0¹⁵,²¹]tetracosa-1(23),2,4,10,16,18,20-heptaene-6,14,22,24-tetrone

C28H29NO8 (507.1893)

3'-hydroxy-n-demethylrocaglamide

C28H29NO8 (507.1893)

{"Ingredient_id": "HBIN008730","Ingredient_name": "3'-hydroxy-n-demethylrocaglamide","Alias": "NA","Ingredient_formula": "C28H29NO8","Ingredient_Smile": "CNC(=O)C1C(C2(C(C1O)(C3=C(C=C(C=C3O2)OC)OC)O)C4=CC(=C(C=C4)OC)O)C5=CC=CC=C5","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9980","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(3s,6r)-19-{[(2s,4r,5r,6s)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-11-hydroxy-3,9-dimethyl-5-oxa-2-azapentacyclo[11.8.0.0²,⁶.0⁷,¹².0¹⁵,²⁰]henicosa-1(13),7,9,11,15,17,19-heptaene-4,14,21-trione

(3s,6r)-19-{[(2s,4r,5r,6s)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-11-hydroxy-3,9-dimethyl-5-oxa-2-azapentacyclo[11.8.0.0²,⁶.0⁷,¹².0¹⁵,²⁰]henicosa-1(13),7,9,11,15,17,19-heptaene-4,14,21-trione

C27H25NO9 (507.1529)

5-({2-[(2-hydroxy-1-methyl-5-oxoimidazol-4-ylidene)amino]-5-[(4-methoxyphenyl)methyl]-3-methylimidazol-4-yl}methyl)-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione

C25H25N5O7 (507.1754)

2,3-dihydroxy-6-(3-hydroxy-4-methoxyphenyl)-10,12-dimethoxy-n-methyl-5-phenyl-7-oxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-triene-4-carboximidic acid

C28H29NO8 (507.1893)

(12s,13s,16s)-9-ethyl-4,12,19-trihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.0⁵,²⁴.0¹⁶,²²]pentacosa-1(24),2,4,10,17,19,21-heptaene-6,15,23,25-tetrone

C28H29NO8 (507.1893)

(9r,10e,12s,13s,16s)-9-ethyl-4,12,19-trihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.0⁵,²⁴.0¹⁶,²²]pentacosa-1(24),2,4,10,17,19,21-heptaene-6,15,23,25-tetrone

C28H29NO8 (507.1893)

(2r)-n-(2-{[2-({2,6-dihydroxy-3h-naphtho[2,1-b][1,4]thiazin-5-yl}sulfanyl)ethyl]-c-hydroxycarbonimidoyl}ethyl)-2,4-dihydroxy-3,3-dimethylbutanimidic acid

C23H29N3O6S2 (507.1498)

5-chloro-8-hydroxy-3-methyl-1-oxo-n-[1-oxo-3-phenyl-1-(2,3,4-trihydroxybutoxy)propan-2-yl]-3,4-dihydro-2-benzopyran-7-carboximidic acid

C24H26ClNO9 (507.1296)

n-{6-[(3-ethyl-6-hydroxy-1,7,12-trioxo-3,4-dihydro-2h-tetraphen-8-yl)oxy]-3-hydroxy-2-methyloxan-4-yl}ethanimidic acid

C28H29NO8 (507.1893)

(s)-{[(2s,3s,4s)-2-amino-1,3,4-trihydroxy-5-(c-hydroxycarbonimidoyloxy)pentylidene]amino}[(2r,3s,4r,5r)-3,4-dihydroxy-5-[4-hydroxy-5-(hydroxymethyl)-2-oxopyrimidin-1-yl]oxolan-2-yl]acetic acid

C17H25N5O13 (507.1449)

2,5,21,28-tetrahydroxy-7-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.0²,¹¹.0⁴,⁹.0¹³,²⁹.0¹⁸,²⁷.0²⁰,²⁵]nonacosa-1(28),4(9),5,7,17(29),18(27),22-heptaene-3,10,26-trione

C26H21NO10 (507.1165)

(10e,12r,15s)-9-ethyl-4,18-dihydroxy-12-(1-hydroxyethyl)-3,15-dimethyl-13-oxa-19-azatetracyclo[18.3.1.0⁵,²³.0¹⁵,²¹]tetracosa-1(23),2,4,10,16,18,20-heptaene-6,14,22,24-tetrone

C28H29NO8 (507.1893)

3-[2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-n-[2-(4-hydroxyphenyl)ethyl]prop-2-enimidic acid

C28H29NO8 (507.1893)

(3s,6s)-19-{[(2s,4r,5r,6s)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-11-hydroxy-3,9-dimethyl-5-oxa-2-azapentacyclo[11.8.0.0²,⁶.0⁷,¹².0¹⁵,²⁰]henicosa-1(13),7,9,11,15,17,19-heptaene-4,14,21-trione

(3s,6s)-19-{[(2s,4r,5r,6s)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-11-hydroxy-3,9-dimethyl-5-oxa-2-azapentacyclo[11.8.0.0²,⁶.0⁷,¹².0¹⁵,²⁰]henicosa-1(13),7,9,11,15,17,19-heptaene-4,14,21-trione

C27H25NO9 (507.1529)

(10s)-5,8-dihydroxy-4-[(1s,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

(10s)-5,8-dihydroxy-4-[(1s,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

C26H25N3O8 (507.1642)

(2r,11s,13r,20s,21r,25r)-2,5,21,28-tetrahydroxy-7-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.0²,¹¹.0⁴,⁹.0¹³,²⁹.0¹⁸,²⁷.0²⁰,²⁵]nonacosa-1(28),4(9),5,7,17(29),18(27),22-heptaene-3,10,26-trione

(2r,11s,13r,20s,21r,25r)-2,5,21,28-tetrahydroxy-7-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.0²,¹¹.0⁴,⁹.0¹³,²⁹.0¹⁸,²⁷.0²⁰,²⁵]nonacosa-1(28),4(9),5,7,17(29),18(27),22-heptaene-3,10,26-trione

C26H21NO10 (507.1165)

{[2-amino-1,3,4-trihydroxy-5-(c-hydroxycarbonimidoyloxy)pentylidene]amino}[(2r,3s,4r,5r)-3,4-dihydroxy-5-[4-hydroxy-5-(hydroxymethyl)-2-oxopyrimidin-1-yl]oxolan-2-yl]acetic acid

C17H25N5O13 (507.1449)

9-ethyl-4,12,19-trihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.0⁵,²⁴.0¹⁶,²²]pentacosa-1(24),2,4,10,17,19,21-heptaene-6,15,23,25-tetrone

C28H29NO8 (507.1893)

(10s)-5,8-dihydroxy-4-[(1r,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

(10s)-5,8-dihydroxy-4-[(1r,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

C26H25N3O8 (507.1642)

n-[(2s,3r,4r,6s)-6-{[(3s)-3-ethyl-6-hydroxy-1,7,12-trioxo-3,4-dihydro-2h-tetraphen-8-yl]oxy}-3-hydroxy-2-methyloxan-4-yl]ethanimidic acid

C28H29NO8 (507.1893)

(10s)-4,8-dihydroxy-5-[(1s,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

(10s)-4,8-dihydroxy-5-[(1s,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

C26H25N3O8 (507.1642)

(9s,10e,12s,13s,16s)-9-ethyl-4,12,19-trihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.0⁵,²⁴.0¹⁶,²²]pentacosa-1(24),2,4,10,17,19,21-heptaene-6,15,23,25-tetrone

C28H29NO8 (507.1893)

19-[(4,5-dihydroxy-6-methyloxan-2-yl)oxy]-11-hydroxy-3,9-dimethyl-5-oxa-2-azapentacyclo[11.8.0.0²,⁶.0⁷,¹².0¹⁵,²⁰]henicosa-1(13),7,9,11,15,17,19-heptaene-4,14,21-trione

C27H25NO9 (507.1529)

(1s,3s,4s,5r,7r,9r,11s,12s,13s)-5-(6-aminopurin-9-yl)-1,4,12-trihydroxy-13-{[(2e)-2-methylbut-2-enoyl]oxy}-2,6,10-trioxatricyclo[7.4.0.0³,⁷]tridecane-11-carboxylic acid

C21H25N5O10 (507.1601)

(2s,3r,4r,5s,6r)-2,3-dihydroxy-6-(3-hydroxy-4-methoxyphenyl)-10,12-dimethoxy-n-methyl-5-phenyl-7-oxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-triene-4-carboximidic acid

C28H29NO8 (507.1893)

3-{[(2s,3r,4s,5s,6r)-6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium

[C23H23O13]+ (507.1139)

3-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium

[C23H23O13]+ (507.1139)

3-carboxy-5-[(1e)-2-[(2s,3r,4s)-5-carboxylato-3-ethenyl-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-pyran-4-yl]ethenyl]-1-ethylpyridin-1-ium

C24H29NO11 (507.1741)

(2s,3s,4s,5s,6r)-2,3-dihydroxy-6-(3-hydroxy-4-methoxyphenyl)-10,12-dimethoxy-n-methyl-5-phenyl-7-oxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-triene-4-carboximidic acid

C28H29NO8 (507.1893)

methyl 4-methyl-3,7-dioxo-10-(5,6,7-trimethoxy-1h-indole-2-carbonyl)-5,10-diazatetracyclo[7.4.0.0¹,¹².0²,⁶]trideca-2(6),8-diene-4-carboxylate

C26H25N3O8 (507.1642)

(10s)-4,8-dihydroxy-5-[(1r,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

(10s)-4,8-dihydroxy-5-[(1r,2s)-2-hydroxy-1-[(5s,6r)-5-hydroxy-6-methyl-2-oxo-5,6-dihydropyran-3-yl]propoxy]-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

C26H25N3O8 (507.1642)

[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-7-ylidene](methyl)oxidanium

[C24H27O12]+ (507.1502)

9-ethyl-4,18-dihydroxy-12-(1-hydroxyethyl)-3,15-dimethyl-13-oxa-19-azatetracyclo[18.3.1.0⁵,²³.0¹⁵,²¹]tetracosa-1(23),2,4,10,16,18,20-heptaene-6,14,22,24-tetrone

C28H29NO8 (507.1893)

(2e)-3-[(2s,3s)-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-n-[2-(4-hydroxyphenyl)ethyl]prop-2-enimidic acid

C28H29NO8 (507.1893)

(10e,12s,13s,16s)-9-ethyl-4,12,19-trihydroxy-3,13,16-trimethyl-14-oxa-20-azatetracyclo[19.3.1.0⁵,²⁴.0¹⁶,²²]pentacosa-1(24),2,4,10,17,19,21-heptaene-6,15,23,25-tetrone

C28H29NO8 (507.1893)