Exact Mass: 512.1965548000001

Exact Mass Matches: 512.1965548000001

Found 283 metabolites which its exact mass value is equals to given mass value 512.1965548000001, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Physalin M

(1S,2S,3R,5R,6R,14R,15S,18R,21S,22R,25S)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1^{2,5}.0^{3,18}.0^{3,21}.0^{6,15}.0^{9,14}]heptacosa-8,10-diene-13,19,24,27-tetrone

C28H32O9 (512.2046222)

Physalin M belongs to the class of organic compounds known as physalins and derivatives. These are steroidal constituents of Physalis plants which possess an unusual 13,14-seco-16,24-cyclo-steroidal ring skeleton (where the bond that is normally present between the 13 and 14 positions in other steroids is broken while a new bond between positions 16 and 24 is formed). Physalin M is an extremely weak basic (essentially neutral) compound (based on its pKa). Physalin M is found in fruits. Physalin M is a constituent of Physalis alkekengi (winter cherry). Constituent of Physalis alkekengi (winter cherry). Physalin M is found in fruits.

11beta-acetoxywalsuranolide

(-)-11beta-Acetoxywalsuranolide

C28H32O9 (512.2046222)

1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone

C24H32O12 (512.1893672)

bisvertinolone

C28H32O9 (512.2046222)

Alectoronic acid

C28H32O9 (512.2046222)

1,2alpha-dehydro-3beta,4beta-dioxolan-daphnetoxin-21-one|genkwanin I

C28H32O9 (512.2046222)

naphthalene-1,8-diol 1,8-bis(4-O-methyl-beta-glucopyranoside)|naphthalene-1,8-diyl bis(4-O-methyl-beta-glucopyranoside)

C24H32O12 (512.1893672)

2,2-dimethyl-2H-(8-hydroxy-6-acetyl)-[2,3-b]-pyran-8-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside

C24H32O12 (512.1893672)

oxosorbiquinol

C28H32O9 (512.2046222)

ACMC-20lgga

C28H32O9 (512.2046222)

Carapolide B

C28H32O9 (512.2046222)

beta-alectoronic acid|beta-alectoronic acid

C28H32O9 (512.2046222)

11-oxo-7alpha-obacunyl acetate|11-Oxo-7??-obacunyl acetate

C28H32O9 (512.2046222)

munronin C

C28H32O9 (512.2046222)

Loperamide hydrochloride

C29H34Cl2N2O2 (512.1997204)

C78276 - Agent Affecting Digestive System or Metabolism > C266 - Antidiarrheal Agent D005765 - Gastrointestinal Agents > D000930 - Antidiarrheals Loperamide (hydrochloride) (R-18553 (hydrochloride)) is an opioid receptor agonist[1][2][3]. Loperamide hydrochloride is a selective and competitive human intestinal carboxylesterases (hiCE) inhibitor. Loperamide hydrochloride has anti-diarrheal effect[4].

C24H32O12_Cyclopenta[c]pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5,6-dihydroxy-7-methyl-, 2-(4-hydroxyphenyl)ethyl ester

NCGC00381305-01_C24H32O12_Cyclopenta[c]pyran-4-carboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-5,6-dihydroxy-7-methyl-, 2-(4-hydroxyphenyl)ethyl ester

C24H32O12 (512.1893672)

1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_major

C24H32O12 (512.1893672)

1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_49.7\\%

C24H32O12 (512.1893672)

1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_88.5\\%

C24H32O12 (512.1893672)

1-[2-[3-[(2R,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxyprop-1-en-2-yl]-2,3-dihydro-1-benzofuran-5-yl]ethanone_47.5\\%

C24H32O12 (512.1893672)

Ala Glu Met Tyr

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

C22H32N4O8S (512.1940751999999)

Ala Glu Tyr Met

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

C22H32N4O8S (512.1940751999999)

Ala Met Glu Tyr

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-4-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid

C22H32N4O8S (512.1940751999999)

Ala Met Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Ala Tyr Glu Met

(4S)-4-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C22H32N4O8S (512.1940751999999)

Ala Tyr Met Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Cys Asp Ile Tyr

(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S,2S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Cys Asp Leu Tyr

(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Cys Asp Tyr Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Cys Asp Tyr Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-4-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Cys Glu Val Tyr

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

C22H32N4O8S (512.1940751999999)

Cys Glu Tyr Val

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

C22H32N4O8S (512.1940751999999)

Cys Ile Asp Tyr

(3S)-3-[(2S,3S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylpentanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Cys Ile Tyr Asp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Cys Leu Asp Tyr

(3S)-3-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-methylpentanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Cys Leu Tyr Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Cys Val Glu Tyr

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

C22H32N4O8S (512.1940751999999)

Cys Val Tyr Glu

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

C22H32N4O8S (512.1940751999999)

Cys Tyr Asp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-3-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Cys Tyr Asp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-4-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Cys Tyr Glu Val

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

C22H32N4O8S (512.1940751999999)

Cys Tyr Ile Asp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-methylpentanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Cys Tyr Leu Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-4-methylpentanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Cys Tyr Val Glu

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

C22H32N4O8S (512.1940751999999)

Asp Cys Ile Tyr

(3S)-3-amino-3-{[(1R)-1-{[(1S,2S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Cys Leu Tyr

(3S)-3-amino-3-{[(1R)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-methylbutyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Cys Tyr Ile

(2S,3S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Asp Cys Tyr Leu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-4-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Asp Phe Met Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanoic acid

C22H32N4O8S (512.1940751999999)

Asp Phe Thr Met

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-phenylpropanamido]-3-hydroxybutanamido]-4-(methylsulfanyl)butanoic acid

C22H32N4O8S (512.1940751999999)

Asp His Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C19H28N8O9 (512.1979158)

Asp His Gln Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoic acid

C19H28N8O9 (512.1979158)

Asp Ile Cys Tyr

(3S)-3-amino-3-{[(1S,2S)-1-{[(1R)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-2-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Ile Tyr Cys

(3S)-3-amino-3-{[(1S,2S)-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Leu Cys Tyr

(3S)-3-amino-3-{[(1S)-1-{[(1R)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-3-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Leu Tyr Cys

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Met Phe Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-3-hydroxybutanoic acid

C22H32N4O8S (512.1940751999999)

Asp Met Thr Phe

(3S)-3-amino-3-{[(1S)-1-{[(1S,2R)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Asn His Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanoic acid

C19H28N8O9 (512.1979158)

Asp Asn Gln His

(3S)-3-amino-3-{[(1S)-2-carbamoyl-1-{[(1S)-3-carbamoyl-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C19H28N8O9 (512.1979158)

Asp Gln His Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanoic acid

C19H28N8O9 (512.1979158)

Asp Gln Asn His

(3S)-3-amino-3-{[(1S)-3-carbamoyl-1-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}propyl]carbamoyl}propanoic acid

C19H28N8O9 (512.1979158)

Asp Thr Phe Met

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanoic acid

C22H32N4O8S (512.1940751999999)

Asp Thr Met Phe

(3S)-3-amino-3-{[(1S,2R)-1-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}-2-hydroxypropyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Tyr Cys Ile

(2S,3S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Asp Tyr Cys Leu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-4-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Asp Tyr Ile Cys

(3S)-3-amino-3-{[(1S)-1-{[(1S,2S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Asp Tyr Leu Cys

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-3-methylbutyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Glu Ala Met Tyr

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

C22H32N4O8S (512.1940751999999)

Glu Ala Tyr Met

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

C22H32N4O8S (512.1940751999999)

Glu Cys Val Tyr

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

C22H32N4O8S (512.1940751999999)

Glu Cys Tyr Val

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

C22H32N4O8S (512.1940751999999)

Glu Phe Met Ser

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

C22H32N4O8S (512.1940751999999)

Glu Phe Ser Met

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

C22H32N4O8S (512.1940751999999)

Glu His Met Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C21H32N6O7S (512.2053082)

Glu His Asn Asn

(4S)-4-amino-4-{[(1S)-1-{[(1S)-2-carbamoyl-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C19H28N8O9 (512.1979158)

Glu His Pro Met

(4S)-4-amino-4-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl]carbamoyl}butanoic acid

C21H32N6O7S (512.2053082)

Glu Met Ala Tyr

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

C22H32N4O8S (512.1940751999999)

Glu Met Phe Ser

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

C22H32N4O8S (512.1940751999999)

Glu Met His Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C21H32N6O7S (512.2053082)

Glu Met Pro His

(4S)-4-amino-4-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}pyrrolidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}butanoic acid

C21H32N6O7S (512.2053082)

Glu Met Ser Phe

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

C22H32N4O8S (512.1940751999999)

Glu Met Tyr Ala

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

C22H32N4O8S (512.1940751999999)

Glu Asn His Asn

(4S)-4-amino-4-{[(1S)-2-carbamoyl-1-{[(1S)-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C19H28N8O9 (512.1979158)

Glu Asn Asn His

(4S)-4-amino-4-{[(1S)-2-carbamoyl-1-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C19H28N8O9 (512.1979158)

Glu Pro His Met

(4S)-4-amino-5-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C21H32N6O7S (512.2053082)

Glu Pro Met His

(4S)-4-amino-5-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C21H32N6O7S (512.2053082)

Glu Ser Phe Met

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

C22H32N4O8S (512.1940751999999)

Glu Ser Met Phe

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

C22H32N4O8S (512.1940751999999)

Glu Val Cys Tyr

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

C22H32N4O8S (512.1940751999999)

Glu Val Tyr Cys

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

C22H32N4O8S (512.1940751999999)

Glu Tyr Ala Met

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

C22H32N4O8S (512.1940751999999)

Glu Tyr Cys Val

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

C22H32N4O8S (512.1940751999999)

Glu Tyr Met Ala

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

C22H32N4O8S (512.1940751999999)

Glu Tyr Val Cys

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

C22H32N4O8S (512.1940751999999)

Phe Asp Met Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanoic acid

C22H32N4O8S (512.1940751999999)

Phe Asp Thr Met

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-4-(methylsulfanyl)butanoic acid

C22H32N4O8S (512.1940751999999)

Phe Glu Met Ser

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

C22H32N4O8S (512.1940751999999)

Phe Glu Ser Met

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

C22H32N4O8S (512.1940751999999)

Phe Met Asp Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-3-hydroxybutanoic acid

C22H32N4O8S (512.1940751999999)

Phe Met Glu Ser

(4S)-4-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid

C22H32N4O8S (512.1940751999999)

Phe Met Ser Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Phe Met Thr Asp

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Phe Ser Glu Met

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

C22H32N4O8S (512.1940751999999)

Phe Ser Met Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Phe Thr Asp Met

(3S)-3-[(2S,3R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxybutanamido]-3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Phe Thr Met Asp

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxybutanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

His Asp Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C19H28N8O9 (512.1979158)

His Asp Gln Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoic acid

C19H28N8O9 (512.1979158)

His Glu Met Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C21H32N6O7S (512.2053082)

His Glu Asn Asn

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

C19H28N8O9 (512.1979158)

His Glu Pro Met

(4S)-4-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-[(2S)-2-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C21H32N6O7S (512.2053082)

His Met Glu Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-(methylsulfanyl)butanamido]-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

C21H32N6O7S (512.2053082)

His Met Pro Glu

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C21H32N6O7S (512.2053082)

His Asn Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C19H28N8O9 (512.1979158)

His Asn Glu Asn

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

C19H28N8O9 (512.1979158)

His Asn Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanamido]-3-carbamoylpropanamido]pentanedioic acid

C19H28N8O9 (512.1979158)

His Asn Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanamido]-4-carbamoylbutanamido]butanedioic acid

C19H28N8O9 (512.1979158)

His Pro Glu Met

(4S)-4-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C21H32N6O7S (512.2053082)

His Pro Met Glu

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-4-(methylsulfanyl)butanamido]pentanedioic acid

C21H32N6O7S (512.2053082)

His Gln Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C19H28N8O9 (512.1979158)

His Gln Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanamido]-3-carbamoylpropanamido]butanedioic acid

C19H28N8O9 (512.1979158)

Ile Cys Asp Tyr

(3S)-3-[(2R)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-sulfanylpropanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Ile Cys Tyr Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Ile Asp Cys Tyr

(3S)-3-[(2S,3S)-2-amino-3-methylpentanamido]-3-{[(1R)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Ile Asp Tyr Cys

(3S)-3-[(2S,3S)-2-amino-3-methylpentanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Ile Tyr Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Ile Tyr Asp Cys

(3S)-3-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Leu Cys Asp Tyr

(3S)-3-[(2R)-2-[(2S)-2-amino-4-methylpentanamido]-3-sulfanylpropanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Leu Cys Tyr Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-methylpentanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Leu Asp Cys Tyr

(3S)-3-[(2S)-2-amino-4-methylpentanamido]-3-{[(1R)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Leu Asp Tyr Cys

(3S)-3-[(2S)-2-amino-4-methylpentanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Leu Tyr Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Leu Tyr Asp Cys

(3S)-3-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(4-hydroxyphenyl)propanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Met Ala Glu Tyr

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

C22H32N4O8S (512.1940751999999)

Met Ala Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Met Asp Phe Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-3-phenylpropanamido]-3-hydroxybutanoic acid

C22H32N4O8S (512.1940751999999)

Met Asp Thr Phe

(3S)-3-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-{[(1S,2R)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-hydroxypropyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Met Glu Ala Tyr

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

C22H32N4O8S (512.1940751999999)

Met Glu Phe Ser

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

C22H32N4O8S (512.1940751999999)

Met Glu His Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C21H32N6O7S (512.2053082)

Met Glu Pro His

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-5-[(2S)-2-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C21H32N6O7S (512.2053082)

Met Glu Ser Phe

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

C22H32N4O8S (512.1940751999999)

Met Glu Tyr Ala

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

C22H32N4O8S (512.1940751999999)

Met Phe Asp Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-3-carboxypropanamido]-3-hydroxybutanoic acid

C22H32N4O8S (512.1940751999999)

Met Phe Glu Ser

(4S)-4-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid

C22H32N4O8S (512.1940751999999)

Met Phe Ser Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-3-hydroxypropanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Met Phe Thr Asp

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-3-hydroxybutanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Met His Glu Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

C21H32N6O7S (512.2053082)

Met His Pro Glu

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C21H32N6O7S (512.2053082)

Met Pro Glu His

(4S)-4-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

C21H32N6O7S (512.2053082)

Met Pro His Glu

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C21H32N6O7S (512.2053082)

Met Ser Glu Phe

(4S)-4-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-4-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}butanoic acid

C22H32N4O8S (512.1940751999999)

Met Ser Phe Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-3-phenylpropanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Met Thr Asp Phe

(3S)-3-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Met Thr Phe Asp

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-3-phenylpropanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Met Tyr Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]propanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Met Tyr Glu Ala

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

C22H32N4O8S (512.1940751999999)

Asn Asp His Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanoic acid

C19H28N8O9 (512.1979158)

Asn Asp Gln His

(3S)-3-[(2S)-2-amino-3-carbamoylpropanamido]-3-{[(1S)-3-carbamoyl-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propyl]carbamoyl}propanoic acid

C19H28N8O9 (512.1979158)

Asn Glu His Asn

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

C19H28N8O9 (512.1979158)

Asn Glu Asn His

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

C19H28N8O9 (512.1979158)

Asn His Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C19H28N8O9 (512.1979158)

Asn His Glu Asn

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

C19H28N8O9 (512.1979158)

Asn His Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanamido]pentanedioic acid

C19H28N8O9 (512.1979158)

Asn His Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanamido]butanedioic acid

C19H28N8O9 (512.1979158)

Asn Asn Glu His

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

C19H28N8O9 (512.1979158)

Asn Asn His Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C19H28N8O9 (512.1979158)

Asn Gln Asp His

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C19H28N8O9 (512.1979158)

Asn Gln His Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C19H28N8O9 (512.1979158)

Pro Glu His Met

(4S)-4-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C21H32N6O7S (512.2053082)

Pro Glu Met His

(4S)-4-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C21H32N6O7S (512.2053082)

Pro His Glu Met

(4S)-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-4-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]butanoic acid

C21H32N6O7S (512.2053082)

Pro His Met Glu

(2S)-2-[(2S)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C21H32N6O7S (512.2053082)

Pro Met Glu His

(4S)-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-4-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]butanoic acid

C21H32N6O7S (512.2053082)

Pro Met His Glu

(2S)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]propanamido]pentanedioic acid

C21H32N6O7S (512.2053082)

Gln Asp His Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanoic acid

C19H28N8O9 (512.1979158)

Gln Asp Asn His

(3S)-3-[(2S)-2-amino-4-carbamoylbutanamido]-3-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C19H28N8O9 (512.1979158)

Gln His Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C19H28N8O9 (512.1979158)

Gln His Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carbamoylpropanamido]butanedioic acid

C19H28N8O9 (512.1979158)

Gln Asn Asp His

(3S)-3-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C19H28N8O9 (512.1979158)

Gln Asn His Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-(1H-imidazol-4-yl)propanamido]butanedioic acid

C19H28N8O9 (512.1979158)

Ser Glu Phe Met

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

C22H32N4O8S (512.1940751999999)

Ser Glu Met Phe

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

C22H32N4O8S (512.1940751999999)

Ser Phe Glu Met

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

C22H32N4O8S (512.1940751999999)

Ser Phe Met Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Ser Met Glu Phe

(4S)-4-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-4-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}butanoic acid

C22H32N4O8S (512.1940751999999)

Ser Met Phe Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Thr Asp Phe Met

(3S)-3-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Thr Asp Met Phe

(3S)-3-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Thr Phe Asp Met

(3S)-3-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-phenylpropanamido]-3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Thr Phe Met Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Thr Met Asp Phe

(3S)-3-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-(methylsulfanyl)butanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Thr Met Phe Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Val Cys Glu Tyr

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

C22H32N4O8S (512.1940751999999)

Val Cys Tyr Glu

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

C22H32N4O8S (512.1940751999999)

Val Glu Cys Tyr

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

C22H32N4O8S (512.1940751999999)

Val Glu Tyr Cys

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

C22H32N4O8S (512.1940751999999)

Val Tyr Cys Glu

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

C22H32N4O8S (512.1940751999999)

Val Tyr Glu Cys

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

C22H32N4O8S (512.1940751999999)

Tyr Ala Glu Met

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

C22H32N4O8S (512.1940751999999)

Tyr Ala Met Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]propanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Tyr Cys Asp Ile

(2S,3S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-carboxypropanamido]-3-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Cys Asp Leu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-carboxypropanamido]-4-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Cys Glu Val

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

C22H32N4O8S (512.1940751999999)

Tyr Cys Ile Asp

(2S)-2-[(2S,3S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-methylpentanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Tyr Cys Leu Asp

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-4-methylpentanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Tyr Cys Val Glu

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

C22H32N4O8S (512.1940751999999)

Tyr Asp Cys Ile

(2S,3S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]-3-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Asp Cys Leu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]-4-methylpentanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Asp Ile Cys

(3S)-3-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-{[(1S,2S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Asp Leu Cys

(3S)-3-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-3-methylbutyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Glu Ala Met

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

C22H32N4O8S (512.1940751999999)

Tyr Glu Cys Val

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

C22H32N4O8S (512.1940751999999)

Tyr Glu Met Ala

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

C22H32N4O8S (512.1940751999999)

Tyr Glu Val Cys

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

C22H32N4O8S (512.1940751999999)

Tyr Ile Cys Asp

(2S)-2-[(2R)-2-[(2S,3S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-methylpentanamido]-3-sulfanylpropanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Tyr Ile Asp Cys

(3S)-3-[(2S,3S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-methylpentanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Leu Cys Asp

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-methylpentanamido]-3-sulfanylpropanamido]butanedioic acid

C22H32N4O8S (512.1940751999999)

Tyr Leu Asp Cys

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-methylpentanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid

C22H32N4O8S (512.1940751999999)

Tyr Met Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]propanamido]pentanedioic acid

C22H32N4O8S (512.1940751999999)

Tyr Met Glu Ala

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

C22H32N4O8S (512.1940751999999)

Tyr Val Cys Glu

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

C22H32N4O8S (512.1940751999999)

Tyr Val Glu Cys

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

C22H32N4O8S (512.1940751999999)

Physalin M

5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1^{2,5}.0^{3,18}.0^{3,21}.0^{6,15}.0^{9,14}]heptacosa-8,10-diene-13,19,24,27-tetrone

C28H32O9 (512.2046222)

ST 26:8;O7

(1beta,3beta,5beta)-1,3,5-[(1R)-ethylidynetris(oxy)]-2beta-acetoxy-14beta-15beta,16beta-epoxy-19-oxo-bufa-20,22-dienolide

C28H32O9 (512.2046222)

Taladegib

LY2940680

C26H24F4N6O (512.1947622)

C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C188731 - Hedgehog Pathway Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor

(4bS,6aS,7S,9aS,9bS)-N-[2,5-Bis(trifluoromethyl)phenyl]-6a-methyl-2-oxo-2,4b,5,6,6a,7,8,9,9a,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinoline-7-carboxamide

C26H26F6N2O2 (512.1898368000001)

Talmapimod

C27H30ClFN4O3 (512.1990352)

C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2149 - Mitogen-Activated Protein Kinase Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor

3-(9-Fluoro-2-(piperidine-1-carbonyl)-1,2,3,4-tetrahydro-[1,4]diazepino[6,7,1-hi]indol-7-yl)-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione

C28H25FN6O3 (512.1972072)

C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor

N-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]-6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide

C28H28N6O2S (512.1994348)

12-Deoxydaunorubicin

C27H30NO9+ (512.192047)

4-(10-Methyl-8-phenyl-6-phenylamino-8,11-dihydro-5,7,8,9,11a-pentaaza-cyclopenta[b]phenanthren-11-yl)-benzene-1,2-diol

C31H24N6O2 (512.1960644)

ST 18:3;O6;GlcA

C24H32O12 (512.1893672)

ST 18:4;O7;Hex

C24H32O12 (512.1893672)

(1r)-2-[(3r)-3-acetyl-2,2-dimethyl-6-oxopyran-3-yl]-1-[(1r,3s,6s,7s,11s)-6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate

C28H32O9 (512.2046222)

6,14-dihydroxy-10-oxo-4,12-bis(2-oxoheptyl)-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid

C28H32O9 (512.2046222)

(1r,3s,4s,5z,7r,8r)-3-hydroxy-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethyl-7-[(1e)-prop-1-en-1-yl]-8-[(5r)-2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl]bicyclo[2.2.2]octane-2,6-dione

(1r,3s,4s,5z,7r,8r)-3-hydroxy-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethyl-7-[(1e)-prop-1-en-1-yl]-8-[(5r)-2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl]bicyclo[2.2.2]octane-2,6-dione

C28H32O9 (512.2046222)

12-(2,3-dihydroxy-3-methylbutyl)-5,8,9-trihydroxy-7-(4-hydroxy-3-methylbut-2-en-1-yl)-2,2-dimethyl-1,11-dioxatetracen-6-one

C28H32O9 (512.2046222)

7a,11b-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione

C28H32O9 (512.2046222)

5,13,17-trihydroxy-7-(2-oxoheptyl)-17-pentyl-2,10,16-trioxatetracyclo[9.8.0.0³,⁸.0¹⁴,¹⁹]nonadeca-1(19),3(8),4,6,11,13-hexaene-9,15-dione

C28H32O9 (512.2046222)

4,6-dihydroxy-3-[(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy]-2-(2-oxoheptyl)benzoic acid

C28H32O9 (512.2046222)

11-oxo-7α-obacunyl acetate

C28H32O9 (512.2046222)

{"Ingredient_id": "HBIN000499","Ingredient_name": "11-oxo-7\u03b1-obacunyl acetate","Alias": "NA","Ingredient_formula": "C28H32O9","Ingredient_Smile": "CC(=O)OC1CC2C(OC(=O)C=CC2(C3C1(C45C(O4)C(=O)OC(C5(CC3=O)C)C6=COC=C6)C)C)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16387","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

6-o-(3,4-dimethoxybenzoyl)-ajugol

C24H32O12 (512.1893672)

{"Ingredient_id": "HBIN012580","Ingredient_name": "6-o-(3,4-dimethoxybenzoyl)-ajugol","Alias": "NA","Ingredient_formula": "C24H32O12","Ingredient_Smile": "CC1(CC(C2C1C(OC=C2)OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C4=CC(=C(C=C4)OC)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6204","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

6,7,12-trihydroxy-4,13-bis(1-hydroxyhexa-2,4-dien-1-ylidene)-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione

C28H32O9 (512.2046222)

(2s,3r,4r,5s,6r)-2-[(8-{[(2s,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}naphthalen-1-yl)oxy]-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol

C24H32O12 (512.1893672)

(7s)-5-chloro-3-(2-hydroxy-6-methylphenyl)-7-methyl-6,8-dioxoisochromen-7-yl (2e)-2,4-dimethyldec-2-enoate

C29H33ClO6 (512.1965548000001)

1-(8-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,2-dimethylchromen-6-yl)ethanone

C24H32O12 (512.1893672)

[(2r,3s,4s,5r,6s)-6-{[(1s,4ar,5r,7s,7as)-5,7-dihydroxy-7-methyl-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dimethoxybenzoate

C24H32O12 (512.1893672)

2-(3-acetyl-2,2-dimethyl-6-oxopyran-3-yl)-1-[6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate

C28H32O9 (512.2046222)

(1s,4ar,5r,7s,7as)-7-hydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 3,4-dimethoxybenzoate

C24H32O12 (512.1893672)

4,13-bis(hexa-2,4-dienoyl)-3,6,7,10,12-pentahydroxy-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,10,12-trien-5-one

C28H32O9 (512.2046222)

3-{[3-carboxy-5-(hexa-1,3-dien-1-yl)-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid

C28H32O9 (512.2046222)

15-(2,2-dimethyl-5-oxooxolan-3-yl)-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate

C28H32O9 (512.2046222)

(1s,2s,3r,5r,6r,14r,15s,18r,21s,22r,25s)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone

(1s,2s,3r,5r,6r,14r,15s,18r,21s,22r,25s)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone

C28H32O9 (512.2046222)

12-[(2s)-2,3-dihydroxy-3-methylbutyl]-5,8,9-trihydroxy-7-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-1,11-dioxatetracen-6-one

C28H32O9 (512.2046222)

(1r,3s,5r,7r,8r,9r,10r,15r)-15-[(3r)-2,2-dimethyl-5-oxooxolan-3-yl]-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate

C28H32O9 (512.2046222)

(1r,2r,4s,7s,8s,10s,12r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-10-yl acetate

C28H32O9 (512.2046222)

(1r,2s,4s,5s,9s,10s,11r,13s,14s,15r,17r,19r,21r)-10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one

(1r,2s,4s,5s,9s,10s,11r,13s,14s,15r,17r,19r,21r)-10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one

C28H32O9 (512.2046222)

10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one

C28H32O9 (512.2046222)

5-chloro-3-(2-hydroxy-6-methylphenyl)-7-methyl-6,8-dioxoisochromen-7-yl 2,4-dimethyldec-2-enoate

C29H33ClO6 (512.1965548000001)

(1r,2r,4e,6s,7s,9s,13z)-6,7,10-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione

C28H32O9 (512.2046222)

1-(8-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,2-dimethylchromen-6-yl)ethanone

C24H32O12 (512.1893672)

(1r,2r,4z,6s,7s,9s,13z)-6,7,12-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione

C28H32O9 (512.2046222)

2-[(8-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}naphthalen-1-yl)oxy]-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol

C24H32O12 (512.1893672)

(3s,5s,7r,8s)-3-{[(5r)-3-carboxy-5-[(1e,3e)-hexa-1,3-dien-1-yl]-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid

(3s,5s,7r,8s)-3-{[(5r)-3-carboxy-5-[(1e,3e)-hexa-1,3-dien-1-yl]-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid

C28H32O9 (512.2046222)