Exact Mass: 514.2097

Exact Mass Matches: 514.2097

Found 152 metabolites which its exact mass value is equals to given mass value 514.2097, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Antibiotic KO 8119A

Antibiotic KO 8119A

C22H34N4O8S (514.2097)


   
   

3-(2-hydroxy-3-methyl-3-butenyl)acetophenone-4-O-[beta-D-arabinopyranosyl-(1->3)]-O-beta-D-galactopyranoside

3-(2-hydroxy-3-methyl-3-butenyl)acetophenone-4-O-[beta-D-arabinopyranosyl-(1->3)]-O-beta-D-galactopyranoside

C24H34O12 (514.205)


   

O-(N-Acetyl-neuraminyl)-(2->6)-2-acetylamino-2-desoxy-D-galactit|O--(2->6)-2-acetylamino-2-desoxy-D-galactit

O-(N-Acetyl-neuraminyl)-(2->6)-2-acetylamino-2-desoxy-D-galactit|O--(2->6)-2-acetylamino-2-desoxy-D-galactit

C19H34N2O14 (514.201)


   

O1,O2,O3,O4-tetraacetyl-O6-(8-hydroxymenth-1-en-7-oyl)-beta-D-glucopyranose

O1,O2,O3,O4-tetraacetyl-O6-(8-hydroxymenth-1-en-7-oyl)-beta-D-glucopyranose

C24H34O12 (514.205)


   

1-O-[3-O-acetyl-alpha-L-rhamnopyranosyl-(1?6)-beta-D-glucopyranosyl]-4-allyl-2-methoxyphenol

1-O-[3-O-acetyl-alpha-L-rhamnopyranosyl-(1?6)-beta-D-glucopyranosyl]-4-allyl-2-methoxyphenol

C24H34O12 (514.205)


   

O2,O3,O4,O6-tetraacetyl-O1-(8-hydroxymenth-1-en-7-oyl)-beta-D-glucopyranose

O2,O3,O4,O6-tetraacetyl-O1-(8-hydroxymenth-1-en-7-oyl)-beta-D-glucopyranose

C24H34O12 (514.205)


   

1-deacetyltinosposide A

1-deacetyltinosposide A

C24H34O12 (514.205)


   

Glu Thr His Glu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C20H30N6O10 (514.2023)


   

Ala Asp Phe Tyr

(3S)-3-[(2S)-2-aminopropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Ala Asp Tyr Phe

(3S)-3-[(2S)-2-aminopropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Ala Phe Asp Tyr

(3S)-3-[(2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Ala Phe Tyr Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C25H30N4O8 (514.2064)


   

Ala Tyr Asp Phe

(3S)-3-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Ala Tyr Phe Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-3-phenylpropanamido]butanedioic acid

C25H30N4O8 (514.2064)


   

Asp Ala Phe Tyr

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

C25H30N4O8 (514.2064)


   

Asp Ala Tyr Phe

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

C25H30N4O8 (514.2064)


   

Asp Phe Ala Tyr

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

C25H30N4O8 (514.2064)


   

Asp Phe Phe Ser

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

C25H30N4O8 (514.2064)


   

Asp Phe His Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C24H30N6O7 (514.2176)


   

Asp Phe Pro His

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

C24H30N6O7 (514.2176)


   

Asp Phe Ser Phe

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

C25H30N4O8 (514.2064)


   

Asp Phe Tyr Ala

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

C25H30N4O8 (514.2064)


   

Asp His Phe Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanoyl]pyrrolidine-2-carboxylic acid

C24H30N6O7 (514.2176)


   

Asp His Pro Phe

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

C24H30N6O7 (514.2176)


   

Asp Pro Phe His

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

C24H30N6O7 (514.2176)


   

Asp Pro His Phe

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

C24H30N6O7 (514.2176)


   

Asp Ser Phe Phe

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

C25H30N4O8 (514.2064)


   

Asp Tyr Ala Phe

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

C25H30N4O8 (514.2064)


   

Asp Tyr Phe Ala

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

C25H30N4O8 (514.2064)


   

Glu Glu His Thr

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

C20H30N6O10 (514.2023)


   

Glu Glu Thr His

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

C20H30N6O10 (514.2023)


   

Glu Phe Gly Tyr

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

C25H30N4O8 (514.2064)


   

Glu Phe Tyr Gly

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

C25H30N4O8 (514.2064)


   

Glu Gly Phe Tyr

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

C25H30N4O8 (514.2064)


   

Glu Gly Tyr Phe

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

C25H30N4O8 (514.2064)


   

Glu His Glu Thr

(4S)-4-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-4-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}butanoic acid

C20H30N6O10 (514.2023)


   

Glu His Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]pentanedioic acid

C20H30N6O10 (514.2023)


   

Glu Thr Glu His

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

C20H30N6O10 (514.2023)


   

Glu Tyr Phe Gly

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

C25H30N4O8 (514.2064)


   

Glu Tyr Gly Phe

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

C25H30N4O8 (514.2064)


   

Phe Ala Asp Tyr

(3S)-3-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]propanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Phe Ala Tyr Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C25H30N4O8 (514.2064)


   

Phe Asp Ala Tyr

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

C25H30N4O8 (514.2064)


   

Phe Asp Phe Ser

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

C25H30N4O8 (514.2064)


   

Phe Asp His Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-carboxypropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C24H30N6O7 (514.2176)


   

Phe Asp Pro His

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

C24H30N6O7 (514.2176)


   

Phe Asp Ser Phe

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

C25H30N4O8 (514.2064)


   

Phe Asp Tyr Ala

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

C25H30N4O8 (514.2064)


   

Phe Glu Gly Tyr

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

C25H30N4O8 (514.2064)


   

Phe Glu Tyr Gly

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

C25H30N4O8 (514.2064)


   

Phe Phe Asp Ser

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

C25H30N4O8 (514.2064)


   

Phe Phe Ser Asp

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

C25H30N4O8 (514.2064)


   

Phe Gly Glu Tyr

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

C25H30N4O8 (514.2064)


   

Phe Gly Tyr Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-phenylpropanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C25H30N4O8 (514.2064)


   

Phe His Asp Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C24H30N6O7 (514.2176)


   

Phe His Pro Asp

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

C24H30N6O7 (514.2176)


   

Phe Pro Asp His

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

C24H30N6O7 (514.2176)


   

Phe Pro His Asp

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

C24H30N6O7 (514.2176)


   

Phe Ser Asp Phe

(3S)-3-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxypropanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Phe Ser Phe Asp

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

C25H30N4O8 (514.2064)


   

Phe Tyr Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]propanamido]butanedioic acid

C25H30N4O8 (514.2064)


   

Phe Tyr Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Phe Tyr Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C25H30N4O8 (514.2064)


   

Phe Tyr Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}pentanedioic acid

C25H30N4O8 (514.2064)


   

Gly Glu Phe Tyr

(4S)-4-(2-aminoacetamido)-4-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-phenylethyl]carbamoyl}butanoic acid

C25H30N4O8 (514.2064)


   

Gly Glu Tyr Phe

(4S)-4-(2-aminoacetamido)-4-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid

C25H30N4O8 (514.2064)


   

Gly Phe Glu Tyr

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

C25H30N4O8 (514.2064)


   

Gly Phe Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C25H30N4O8 (514.2064)


   

Gly Tyr Glu Phe

(4S)-4-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-4-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}butanoic acid

C25H30N4O8 (514.2064)


   

Gly Tyr Phe Glu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-phenylpropanamido]pentanedioic acid

C25H30N4O8 (514.2064)


   

His Asp Phe Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-carboxypropanamido]-3-phenylpropanoyl]pyrrolidine-2-carboxylic acid

C24H30N6O7 (514.2176)


   

His Asp Pro Phe

(3S)-3-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-[(2S)-2-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}pyrrolidin-1-yl]-4-oxobutanoic acid

C24H30N6O7 (514.2176)


   

His Glu Glu Thr

(4S)-4-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]-4-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}butanoic acid

C20H30N6O10 (514.2023)


   

His Glu Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]-3-hydroxybutanamido]pentanedioic acid

C20H30N6O10 (514.2023)


   

His Phe Asp Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C24H30N6O7 (514.2176)


   

His Phe Pro Asp

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

C24H30N6O7 (514.2176)


   

His Met Met Pro

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

C21H34N6O5S2 (514.2032)


   

His Met Pro Met

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

C21H34N6O5S2 (514.2032)


   

His Pro Asp Phe

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

C24H30N6O7 (514.2176)


   

His Pro Phe Asp

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

C24H30N6O7 (514.2176)


   

His Pro Met Met

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

C21H34N6O5S2 (514.2032)


   

His Thr Glu Glu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]-4-carboxybutanamido]pentanedioic acid

C20H30N6O10 (514.2023)


   

Met His Met Pro

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

C21H34N6O5S2 (514.2032)


   

Met His Pro Met

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

C21H34N6O5S2 (514.2032)


   

Met Met His Pro

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

C21H34N6O5S2 (514.2032)


   

Met Met Pro His

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

C21H34N6O5S2 (514.2032)


   

Met Pro His Met

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

C21H34N6O5S2 (514.2032)


   

Met Pro Met His

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

C21H34N6O5S2 (514.2032)


   

Met Thr Thr Tyr

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

C22H34N4O8S (514.2097)


   

Met Thr Tyr Thr

(2S,3R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanoic acid

C22H34N4O8S (514.2097)


   

Met Tyr Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C22H34N4O8S (514.2097)


   

Pro Asp Phe His

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

C24H30N6O7 (514.2176)


   

Pro Asp His Phe

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

C24H30N6O7 (514.2176)


   

Pro Phe Asp His

(3S)-3-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-3-[(2S)-3-phenyl-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]propanoic acid

C24H30N6O7 (514.2176)


   

Pro Phe His Asp

(2S)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-3-phenyl-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]propanamido]butanedioic acid

C24H30N6O7 (514.2176)


   

Pro His Asp Phe

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

C24H30N6O7 (514.2176)


   

Pro His Phe Asp

(2S)-2-[(2S)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-3-phenylpropanamido]butanedioic acid

C24H30N6O7 (514.2176)


   

Pro His Met Met

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

C21H34N6O5S2 (514.2032)


   

Pro Met His Met

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

C21H34N6O5S2 (514.2032)


   

Pro Met Met His

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

C21H34N6O5S2 (514.2032)


   

Ser Asp Phe Phe

(3S)-3-[(2S)-2-amino-3-hydroxypropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Ser Phe Asp Phe

(3S)-3-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-phenylpropanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Ser Phe Phe Asp

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

C25H30N4O8 (514.2064)


   

Thr Glu Glu His

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

C20H30N6O10 (514.2023)


   

Thr Glu His Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

C20H30N6O10 (514.2023)


   

Thr His Glu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]pentanedioic acid

C20H30N6O10 (514.2023)


   

Thr Met Thr Tyr

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

C22H34N4O8S (514.2097)


   

Thr Met Tyr Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-(methylsulfanyl)butanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanoic acid

C22H34N4O8S (514.2097)


   

Thr Thr Met Tyr

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

C22H34N4O8S (514.2097)


   

Thr Thr Tyr Met

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

C22H34N4O8S (514.2097)


   

Thr Tyr Met Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanoic acid

C22H34N4O8S (514.2097)


   

Thr Tyr Thr Met

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

C22H34N4O8S (514.2097)


   

Tyr Ala Asp Phe

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

C25H30N4O8 (514.2064)


   

Tyr Ala Phe Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]propanamido]-3-phenylpropanamido]butanedioic acid

C25H30N4O8 (514.2064)


   

Tyr Asp Ala Phe

(3S)-3-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Tyr Asp Phe Ala

(3S)-3-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Tyr Glu Phe Gly

(4S)-4-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-{[(1S)-1-[(carboxymethyl)carbamoyl]-2-phenylethyl]carbamoyl}butanoic acid

C25H30N4O8 (514.2064)


   

Tyr Glu Gly Phe

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

C25H30N4O8 (514.2064)


   

Tyr Phe Ala Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-phenylpropanamido]propanamido]butanedioic acid

C25H30N4O8 (514.2064)


   

Tyr Phe Asp Ala

(3S)-3-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-phenylpropanamido]-3-{[(1S)-1-carboxyethyl]carbamoyl}propanoic acid

C25H30N4O8 (514.2064)


   

Tyr Phe Glu Gly

(4S)-4-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-phenylpropanamido]-4-[(carboxymethyl)carbamoyl]butanoic acid

C25H30N4O8 (514.2064)


   

Tyr Phe Gly Glu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-phenylpropanamido]acetamido}pentanedioic acid

C25H30N4O8 (514.2064)


   

Tyr Gly Glu Phe

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

C25H30N4O8 (514.2064)


   

Tyr Gly Phe Glu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-phenylpropanamido]pentanedioic acid

C25H30N4O8 (514.2064)


   

Tyr Met Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C22H34N4O8S (514.2097)


   

Tyr Thr Met Thr

(2S,3R)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxybutanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanoic acid

C22H34N4O8S (514.2097)


   

Tyr Thr Thr Met

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

C22H34N4O8S (514.2097)


   

2-(n-boc-amino)-5-(n-fmoc-amino)indan-2-carboxylic acid

2-(n-boc-amino)-5-(n-fmoc-amino)indan-2-carboxylic acid

C30H30N2O6 (514.2104)


   

Fmoc-Phe-Ser(psi(Me,Me)pro)-OH

Fmoc-Phe-Ser(psi(Me,Me)pro)-OH

C30H30N2O6 (514.2104)


   
   

13-Deoxydaunorubicin(1+)

13-Deoxydaunorubicin(1+)

C27H32NO9+ (514.2077)


An organic cation that is the conjugate acid of 13-deoxydaunorubicin, obtained by protonation of the primary amino function.

   

[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]-[(1S,2S,3R,4R,5S,6R)-2,3,6-trihydroxy-5-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]azanium

[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]-[(1S,2S,3R,4R,5S,6R)-2,3,6-trihydroxy-5-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]azanium

C20H36NO14+ (514.2136)


   

3-[4-[2-(2-Fluorophenyl)ethylamino]-3-nitrophenyl]-3-[[2-(1-naphthalenyl)-1-oxoethyl]amino]propanamide

3-[4-[2-(2-Fluorophenyl)ethylamino]-3-nitrophenyl]-3-[[2-(1-naphthalenyl)-1-oxoethyl]amino]propanamide

C29H27FN4O4 (514.2016)


   

2-[(3S,6aS,8R,10aS)-3-hydroxy-1-(4-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

2-[(3S,6aS,8R,10aS)-3-hydroxy-1-(4-methylphenyl)sulfonyl-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

C27H34N2O6S (514.2137)


   

Asp-Phe-Pro-His

Asp-Phe-Pro-His

C24H30N6O7 (514.2176)


   
   
   

ST 18:2;O6;GlcA

ST 18:2;O6;GlcA

C24H34O12 (514.205)


   

ST 18:3;O7;Hex

ST 18:3;O7;Hex

C24H34O12 (514.205)


   

(2s,3r,4s,5r,6r)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl (4r)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

(2s,3r,4s,5r,6r)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl (4r)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

C24H34O12 (514.205)


   

n-[1-(5-{[5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl)-2-hydroxypyrimidin-4-ylidene]-3-(methylsulfanyl)prop-2-enamide

n-[1-(5-{[5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl)-2-hydroxypyrimidin-4-ylidene]-3-(methylsulfanyl)prop-2-enamide

C22H34N4O8S (514.2097)


   

[3,4,5,6-tetrakis(acetyloxy)oxan-2-yl]methyl 4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

[3,4,5,6-tetrakis(acetyloxy)oxan-2-yl]methyl 4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

C24H34O12 (514.205)


   

(2e)-n-{1-[(2s,4s,5r,6r)-5-{[(2s,3r,4s,5r,6s)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]-2-hydroxypyrimidin-4-ylidene}-3-(methylsulfanyl)prop-2-enamide

(2e)-n-{1-[(2s,4s,5r,6r)-5-{[(2s,3r,4s,5r,6s)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]-2-hydroxypyrimidin-4-ylidene}-3-(methylsulfanyl)prop-2-enamide

C22H34N4O8S (514.2097)


   

2-(furan-3-yl)-4a,9,10-trihydroxy-10b-methyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydronaphtho[2,1-c]pyran-4-one

2-(furan-3-yl)-4a,9,10-trihydroxy-10b-methyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydronaphtho[2,1-c]pyran-4-one

C24H34O12 (514.205)


   

(2s,4as,6as,7r,9s,10r,10ar,10bs)-2-(furan-3-yl)-4a,9,10-trihydroxy-10b-methyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydronaphtho[2,1-c]pyran-4-one

(2s,4as,6as,7r,9s,10r,10ar,10bs)-2-(furan-3-yl)-4a,9,10-trihydroxy-10b-methyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-decahydronaphtho[2,1-c]pyran-4-one

C24H34O12 (514.205)


   

(2e)-n-{1-[(2r,4r,5s,6r)-5-{[(2r,3r,4s,5s,6r)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]-2-hydroxypyrimidin-4-ylidene}-3-(methylsulfanyl)prop-2-enamide

(2e)-n-{1-[(2r,4r,5s,6r)-5-{[(2r,3r,4s,5s,6r)-5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl]-2-hydroxypyrimidin-4-ylidene}-3-(methylsulfanyl)prop-2-enamide

C22H34N4O8S (514.2097)


   

[(2r,3r,4s,5r,6s)-3,4,5,6-tetrakis(acetyloxy)oxan-2-yl]methyl (4s)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

[(2r,3r,4s,5r,6s)-3,4,5,6-tetrakis(acetyloxy)oxan-2-yl]methyl (4s)-4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

C24H34O12 (514.205)


   

(2e)-n-[1-(5-{[5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl)-2-hydroxypyrimidin-4-ylidene]-3-(methylsulfanyl)prop-2-enamide

(2e)-n-[1-(5-{[5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-4-hydroxy-6-methyloxan-2-yl)-2-hydroxypyrimidin-4-ylidene]-3-(methylsulfanyl)prop-2-enamide

C22H34N4O8S (514.2097)


   

2-{3-[(2-amino-1,3-dihydroxypropylidene)amino]-6-[2-hydroxy-5-(hydroxymethyl)-4-iminopyrimidin-1-yl]-3,6-dihydro-2h-pyran-2-yl}-5-carbamimidamido-2,4-dihydroxypentanoic acid

2-{3-[(2-amino-1,3-dihydroxypropylidene)amino]-6-[2-hydroxy-5-(hydroxymethyl)-4-iminopyrimidin-1-yl]-3,6-dihydro-2h-pyran-2-yl}-5-carbamimidamido-2,4-dihydroxypentanoic acid

C19H30N8O9 (514.2136)


   

3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl 4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl 4-(2-hydroxypropan-2-yl)cyclohex-1-ene-1-carboxylate

C24H34O12 (514.205)


   

2-[(2s,3s,6r)-3-[(2-amino-1,3-dihydroxypropylidene)amino]-6-[2-hydroxy-5-(hydroxymethyl)-4-iminopyrimidin-1-yl]-3,6-dihydro-2h-pyran-2-yl]-5-carbamimidamido-2,4-dihydroxypentanoic acid

2-[(2s,3s,6r)-3-[(2-amino-1,3-dihydroxypropylidene)amino]-6-[2-hydroxy-5-(hydroxymethyl)-4-iminopyrimidin-1-yl]-3,6-dihydro-2h-pyran-2-yl]-5-carbamimidamido-2,4-dihydroxypentanoic acid

C19H30N8O9 (514.2136)