Exact Mass: 552.2207

Exact Mass Matches: 552.2207

Found 212 metabolites which its exact mass value is equals to given mass value 552.2207, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

1-[3-(3-Chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)propyl]-4-(1-piperidyl)piperidine-4-carboxamide

C28H39Cl3N4O (552.2189)

Prupaside

2-{[2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-3-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

Prupaside is found in fruits. Prupaside is isolated from Prunus padus (bird cherry). Isolated from Prunus padus (bird cherry). Prupaside is found in fruits.

Lyoniside

2-{[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

(4S)-3-{{{6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxoprop-2-en-1-yl]-beta-D-glucopyranosyl}oxy}methyl}-4-(hydroxymethyl)-5,5-dimethylcyclohex-2-en-1-one|6-O-trans-sinapoyljasminoside B

C27H36O12 (552.2207)

tetra-O-methylcurculigine|tetramethylcurculigine

C27H36O12 (552.2207)

haterumalide B

C28H37ClO9 (552.2126)

(4R)-4-{{6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxoprop-2-en-1-yl]-beta-D-glucopyranosyl}oxy}-2,6,6-trimethylcyclohex-1-ene-1-carboxylic acid|6-O-trans-sinapoyljasminoside L

C27H36O12 (552.2207)

(+)-5-methoxy-isolariciresinol-3alpha-O-beta-D-glucopyranoside|(+)-5-methoxyisolariciresinol 9-O-beta-D-glucopyranoside

C27H36O12 (552.2207)

(-)-lyoniresinol; 3alpha-O-beta-D-xylopyranoside

C27H36O12 (552.2207)

borapetoside B

C27H36O12 (552.2207)

4-[(erythro) 2,3-dihydro-3(hydroxymethyl)-5-(3-hydropropyl)-7-methoxy-2-benzofuranyl]-2,6-dimethoxyphenyl-beta-D-glucopyranoside|rel-(7R,8S)-3,3,5-trimethoxy-4,7-epoxy-8,5-neolignan-4,9,9-triol 4-beta-D-glucopyranoside|rel-4-[(2S,3R)-2,3-dihydro-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran-2-yl]-2,6-dimethoxyphenyl beta-D-glucopyranoside

4-[(erythro) 2,3-dihydro-3(hydroxymethyl)-5-(3-hydropropyl)-7-methoxy-2-benzofuranyl]-2,6-dimethoxyphenyl-beta-D-glucopyranoside|rel-(7R,8S)-3,3,5-trimethoxy-4,7-epoxy-8,5-neolignan-4,9,9-triol 4-beta-D-glucopyranoside|rel-4-[(2S,3R)-2,3-dihydro-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran-2-yl]-2,6-dimethoxyphenyl beta-D-glucopyranoside

C27H36O12 (552.2207)

cutrusin B

C27H36O12 (552.2207)

Rumphioside I

C27H36O12 (552.2207)

2-[3-methoxy,4-(O-beta-D-galactopyranos-1-yl)benzyl]-3-(3,4dimethoxybenzyl)-4-hydroxybutyric acid|aconiside

C27H36O12 (552.2207)

(+)-5-methoxyisolariciresinol 3a-O-beta-glucopyranoside

C27H36O12 (552.2207)

(2S,4aR,6aR,9R,10aR,10bS)-2-(3-furanyl)-9-(beta-D-glucopyranosyloxy)-1,4,4a,5,6,6a,9,10,10a,10b-decahydro-4a-hydroxyl-6a,10b-dimethyl-4-oxo-2H-naphtho[2,1-c]pyran-7-carboxylic acid methyl ester|tinospinoside C

(2S,4aR,6aR,9R,10aR,10bS)-2-(3-furanyl)-9-(beta-D-glucopyranosyloxy)-1,4,4a,5,6,6a,9,10,10a,10b-decahydro-4a-hydroxyl-6a,10b-dimethyl-4-oxo-2H-naphtho[2,1-c]pyran-7-carboxylic acid methyl ester|tinospinoside C

C27H36O12 (552.2207)

SCHEMBL12544539

C27H36O12 (552.2207)

5-methoxy-(+)-isolariciresinol-4-O-beta-D-glucopyranoside

C27H36O12 (552.2207)

[4-[5,7-dihydroxy-8-(3-methylbut-2-enyl)-2-oxo-4-phenylchromen-6-yl]-2-methyl-4-oxobutyl] 3-phenylprop-2-enoate

C34H32O7 (552.2148)

2beta-[3,5-dimethoxy-4-O-(beta-D-glucopyranosyl)phenyl]-3alpha-hydroxymethyl-4alpha-[(4-hydroxy-3-methoxyphenyl)methyl]tetrahydrofuran|conicaoside

C27H36O12 (552.2207)

(-)-Lyoniresinol-2-xyloside

C27H36O12 (552.2207)

(3R,4R,5R,6S,8R,9S,10S,12S)-15,16-epoxy-3,4-epoxy-6-O-(beta-D-glucopyranosyl)-cleroda-3,13(16),14-trien-17,12-olid-18-oic acid methyl ester

C27H36O12 (552.2207)

tortoside E

C27H36O12 (552.2207)

1beta,5alpha,7alphaH-2alpha-Acetoxy-4alpha-O-beta-D-(2,6-O-diacetyl)glucopyranosylguaia-10(14),11(13)dien-8beta,12-olide|1beta,5alpha,7alphaH-2alpha-Acetoxy-4alpha-O-beta-D-<2,6-O-diacetyl>glucopyranosylguaia-10(14),11(13)dien-8beta,12-olide

1beta,5alpha,7alphaH-2alpha-Acetoxy-4alpha-O-beta-D-(2,6-O-diacetyl)glucopyranosylguaia-10(14),11(13)dien-8beta,12-olide|1beta,5alpha,7alphaH-2alpha-Acetoxy-4alpha-O-beta-D-<2,6-O-diacetyl>glucopyranosylguaia-10(14),11(13)dien-8beta,12-olide

C27H36O12 (552.2207)

(+)-(7S,8R,8S)-4,4,9-trihydroxy-3,3,5-trimethoxy-2,7-lignan 9-O-beta-D-glucopyranoside|(6R,7R,8S)-7a-[(beta-D-glucopyranosyl)oxy]-1-methoxyisolariciresinol|[(1S,2S,3R)-1,2,3,4-tetrahydro-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxynaphthalen-2-yl]methyl beta-D-glucopyranoside

(+)-(7S,8R,8S)-4,4,9-trihydroxy-3,3,5-trimethoxy-2,7-lignan 9-O-beta-D-glucopyranoside|(6R,7R,8S)-7a-[(beta-D-glucopyranosyl)oxy]-1-methoxyisolariciresinol|[(1S,2S,3R)-1,2,3,4-tetrahydro-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxynaphthalen-2-yl]methyl beta-D-glucopyranoside

C27H36O12 (552.2207)

rel-(7R,8S)-3,3,5-trimethoxy-4,7-epoxy-8,5-neolignan-4,9,9-triol 9-beta-D-glucopyranoside|rel-[(2R,3S)-2,3-dihydro-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran-3-yl]methyl beta-D-glucopyranoside

rel-(7R,8S)-3,3,5-trimethoxy-4,7-epoxy-8,5-neolignan-4,9,9-triol 9-beta-D-glucopyranoside|rel-[(2R,3S)-2,3-dihydro-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran-3-yl]methyl beta-D-glucopyranoside

C27H36O12 (552.2207)

Tyr Gln Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanamido]-3-carbamoylpropanamido]pentanedioic acid

C23H32N6O10 (552.218)

Asn Gln Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C23H32N6O10 (552.218)

C27H36O12_1-Cyclohexene-1-carboxylic acid, 4-[[6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]-beta-D-glucopyranosyl]oxy]-2,6,6-trimethyl

NCGC00380895-01_C27H36O12_1-Cyclohexene-1-carboxylic acid, 4-[[6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxo-2-propen-1-yl]-beta-D-glucopyranosyl]oxy]-2,6,6-trimethyl-

C27H36O12 (552.2207)

2-[[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]oxane-3,4,5-triol

C27H36O12 (552.2207)

2-[[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]oxane-3,4,5-triol_major

C27H36O12 (552.2207)

Cys Phe Phe His

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C27H32N6O5S (552.2155)

Cys Phe His Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanoic acid

C27H32N6O5S (552.2155)

Cys His Phe Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]-3-phenylpropanoic acid

C27H32N6O5S (552.2155)

Asp Gln Gln Tyr

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

C23H32N6O10 (552.218)

Asp Gln Tyr Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carbamoylbutanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Asp Tyr Gln Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Glu His His Met

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

C22H32N8O7S (552.2115)

Glu His Met His

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

C22H32N8O7S (552.2115)

Glu Met His His

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

C22H32N8O7S (552.2115)

Glu Asn Gln Tyr

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

C23H32N6O10 (552.218)

Glu Asn Tyr Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-carbamoylpropanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Glu Gln Asn Tyr

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

C23H32N6O10 (552.218)

Glu Gln Tyr Asn

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

C23H32N6O10 (552.218)

Glu Tyr Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Glu Tyr Gln Asn

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

C23H32N6O10 (552.218)

Phe Cys Phe His

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C27H32N6O5S (552.2155)

Phe Cys His Phe

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanoic acid

C27H32N6O5S (552.2155)

Phe Phe Cys His

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C27H32N6O5S (552.2155)

Phe Phe His Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoic acid

C27H32N6O5S (552.2155)

Phe His Cys Phe

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C27H32N6O5S (552.2155)

Phe His Phe Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C27H32N6O5S (552.2155)

His Cys Phe Phe

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-phenylpropanoic acid

C27H32N6O5S (552.2155)

His Glu His Met

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

C22H32N8O7S (552.2115)

His Glu Met His

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

C22H32N8O7S (552.2115)

His Phe Cys Phe

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C27H32N6O5S (552.2155)

His Phe Phe Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-phenylpropanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C27H32N6O5S (552.2155)

His His Glu Met

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

C22H32N8O7S (552.2115)

His His Met Glu

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

C22H32N8O7S (552.2115)

His Met Glu His

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

C22H32N8O7S (552.2115)

His Met His Glu

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

C22H32N8O7S (552.2115)

Met Glu His His

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

C22H32N8O7S (552.2115)

Met His Glu His

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

C22H32N8O7S (552.2115)

Met His His Glu

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

C22H32N8O7S (552.2115)

Asn Glu Gln Tyr

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

C23H32N6O10 (552.218)

Asn Glu Tyr Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Asn Gln Glu Tyr

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

C23H32N6O10 (552.218)

Asn Tyr Glu Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(4-hydroxyphenyl)propanamido]-4-carboxybutanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Asn Tyr Gln Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanamido]pentanedioic acid

C23H32N6O10 (552.218)

Gln Asp Gln Tyr

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

C23H32N6O10 (552.218)

Gln Asp Tyr Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Gln Glu Asn Tyr

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

C23H32N6O10 (552.218)

Gln Glu Tyr Asn

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

C23H32N6O10 (552.218)

Gln Asn Glu Tyr

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

C23H32N6O10 (552.218)

Gln Asn Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C23H32N6O10 (552.218)

Gln Gln Asp Tyr

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

C23H32N6O10 (552.218)

Gln Gln Tyr Asp

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

C23H32N6O10 (552.218)

Gln Tyr Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Gln Tyr Glu Asn

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

C23H32N6O10 (552.218)

Gln Tyr Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(4-hydroxyphenyl)propanamido]-3-carbamoylpropanamido]pentanedioic acid

C23H32N6O10 (552.218)

Gln Tyr Gln Asp

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

C23H32N6O10 (552.218)

Tyr Asp Gln Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-4-carbamoylbutanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Tyr Glu Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-carboxybutanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Tyr Glu Gln Asn

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

C23H32N6O10 (552.218)

Tyr Asn Glu Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carbamoylpropanamido]-4-carboxybutanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Tyr Asn Gln Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carbamoylpropanamido]-4-carbamoylbutanamido]pentanedioic acid

C23H32N6O10 (552.218)

Tyr Gln Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-carbamoylbutanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C23H32N6O10 (552.218)

Tyr Gln Glu Asn

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

C23H32N6O10 (552.218)

Tyr Gln Gln Asp

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

C23H32N6O10 (552.218)

Prupaside

2-{[2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-3-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

CHLORODIHYDRIDO[BIS(2-DI-I-PROPYLPHOSPHINOETHYL)AMINE]IRIDIUM(III)

C16H42ClIrN2P2 (552.2141)

2-(2-Chloroanilino)-6-(Dibutylamino)Fluoran

C34H33ClN2O3 (552.218)

BIS(TRIPHENYLPHOSPHINE)IMINIUM BOROHYDRIDE

C36H33BNP2 (552.2181)

[[(1S)-1α-(3,5-Dimethoxy-4-hydroxyphenyl)-3α-(hydroxymethyl)-6,8-dimethoxy-7-hydroxytetralin-2β-yl]methyl]β-D-xylopyranoside

C27H36O12 (552.2207)

Ac-Ser-Gln-Asn-Tyr-OH

C23H32N6O10 (552.218)

Clocapramine hydrochloride

C28H39Cl3N4O (552.2189)

ravidomycin M

C30H34NO9+ (552.2233)

4-[[[(4S,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

N-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

4-[[[(4S,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

(5R,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

(5S,6S,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

(4R,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-N-propan-2-yl-14-(2,2,2-trifluoroethylsulfonylamino)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-5-carboxamide

C23H35F3N4O6S (552.2229)

N-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

4-[[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

4-[[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

4-[[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

4-[[[(4S,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

4-[[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

4-[[[(4R,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-8-(2-methylphenyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl-methylamino]methyl]benzoic acid

C30H36N2O6S (552.2294)

(5S,6S,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

N-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

(5R,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

(5R,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

(5S,6R,9S)-5-methoxy-3,6,9-trimethyl-2-oxo-N-propyl-14-(2,2,2-trifluoroethylsulfonylamino)-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-8-carboxamide

C23H35F3N4O6S (552.2229)

(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-N-propan-2-yl-14-(2,2,2-trifluoroethylsulfonylamino)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-5-carboxamide

C23H35F3N4O6S (552.2229)

(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-N-propan-2-yl-14-(2,2,2-trifluoroethylsulfonylamino)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-5-carboxamide

C23H35F3N4O6S (552.2229)

(4R,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-N-propan-2-yl-14-(2,2,2-trifluoroethylsulfonylamino)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-5-carboxamide

C23H35F3N4O6S (552.2229)

(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-N-propan-2-yl-14-(2,2,2-trifluoroethylsulfonylamino)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-5-carboxamide

C23H35F3N4O6S (552.2229)

(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-N-propan-2-yl-14-(2,2,2-trifluoroethylsulfonylamino)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-triene-5-carboxamide

C23H35F3N4O6S (552.2229)

N-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-3-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

N-[[(10R,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-2-methoxy-N-methylbenzenesulfonamide

C30H36N2O6S (552.2294)

1,2-difluoroethanol;1-(1,2-difluoroethyl)pyrrolidin-2-one;N-[[1-(1,2-difluoroethyl)triazol-4-yl]methyl]-N-(2-fluoroethyl)pentanediamide

C20H31F7N6O4 (552.2295)

ST 21:4;O6;GlcA

C27H36O12 (552.2207)

ST 21:5;O7;Hex

C27H36O12 (552.2207)

(2r,3r,4s,5s,6r)-2-{[(2s,3s,4r)-6-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

methyl (1s,2r,5r,7s,8s,9r)-8-[2-(furan-3-yl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-5-hydroxy-2,8-dimethyl-10-oxo-11-oxatricyclo[7.2.1.0²,⁷]dodec-3-ene-3-carboxylate

methyl (1s,2r,5r,7s,8s,9r)-8-[2-(furan-3-yl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-5-hydroxy-2,8-dimethyl-10-oxo-11-oxatricyclo[7.2.1.0²,⁷]dodec-3-ene-3-carboxylate

C27H36O12 (552.2207)

(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-{4-[(2r,3s)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2,6-dimethoxyphenoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

(2r,3r,4s,5r)-2-{[(2s,3r,4r)-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]oxolan-3-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

(2s,3r,4s,5s,6r)-2-{4-[(1r,2r)-1-hydroxy-2-{4-[(1e)-3-hydroxyprop-1-en-1-yl]-2,6-dimethoxyphenoxy}propyl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2r,3r,4s,5s,6r)-2-{[(1s,2s,3r)-7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(3ar,4r,6ar,8s,9ar,9br)-3,6,9-trimethylidene-2-oxo-8-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-4-yl (2r)-2-ethyl-2-hydroxy-3-oxobutanoate

C27H36O12 (552.2207)

(3,4,5-trihydroxy-6-{[6-(hydroxymethyl)-5,5-dimethyl-3-oxocyclohex-1-en-1-yl]methoxy}oxan-2-yl)methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

C27H36O12 (552.2207)

3,6,9-trimethylidene-2-oxo-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydroazuleno[4,5-b]furan-4-yl 2-ethyl-2-hydroxy-3-oxobutanoate

C27H36O12 (552.2207)

methyl (1s,2r,5r,7s,8s,9r)-8-[(2s)-2-(furan-3-yl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-5-hydroxy-2,8-dimethyl-10-oxo-11-oxatricyclo[7.2.1.0²,⁷]dodec-3-ene-3-carboxylate

methyl (1s,2r,5r,7s,8s,9r)-8-[(2s)-2-(furan-3-yl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-5-hydroxy-2,8-dimethyl-10-oxo-11-oxatricyclo[7.2.1.0²,⁷]dodec-3-ene-3-carboxylate

C27H36O12 (552.2207)

(2s,3r,4r,5s)-2-{[(1r,2s,3s)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-5-(hydroxymethyl)oxolane-3,4-diol

C27H36O12 (552.2207)

4-[5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2-oxo-4-phenylchromen-6-yl]-2-methyl-4-oxobutyl 3-phenylprop-2-enoate

C34H32O7 (552.2148)

2-(4-{4-[(3,4-dimethoxyphenyl)(hydroxy)methyl]-3-(hydroxymethyl)oxolan-2-yl}-2-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

3-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-[(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl]butanoic acid

C27H36O12 (552.2207)

2-{[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

[5-(acetyloxy)-6-{[7-(acetyloxy)-5-methyl-3,8-dimethylidene-2-oxo-octahydroazuleno[6,5-b]furan-5-yl]oxy}-3,4-dihydroxyoxan-2-yl]methyl acetate

C27H36O12 (552.2207)

(2s,3r,4s,5s,6r)-2-(4-{[(3s,4s,5r)-5-(4-hydroxy-3,5-dimethoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl}-2-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

5alpha-decinnamoyltaxagifine

5α-decinnamoyltaxagifine

C27H36O12 (552.2207)

{"Ingredient_id": "HBIN011418","Ingredient_name": "5alpha-decinnamoyltaxagifine","Alias": "5\u03b1-decinnamoyltaxagifine","Ingredient_formula": "C27H36O12","Ingredient_Smile": "CC(=O)OC1CC(C(=C)C2C1C(C(C3(C4(COC3(C(=O)CC4C2OC(=O)C)C)C)O)OC(=O)C)OC(=O)C)O","Ingredient_weight": "552.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "25956;4852","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "132529426","DrugBank_id": "NA"}

methyl (1s,2s,4s,7r,9s,10s,11s,13r)-4-(furan-3-yl)-2,10-dimethyl-6-oxo-9-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,12-dioxatetracyclo[8.5.0.0²,⁷.0¹¹,¹³]pentadecane-11-carboxylate

methyl (1s,2s,4s,7r,9s,10s,11s,13r)-4-(furan-3-yl)-2,10-dimethyl-6-oxo-9-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,12-dioxatetracyclo[8.5.0.0²,⁷.0¹¹,¹³]pentadecane-11-carboxylate

C27H36O12 (552.2207)

methyl (2s,4as,6r,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

methyl (2s,4as,6r,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

C27H36O12 (552.2207)

(2r,3r,4s,5s,6r)-2-{[(2s,3r,4r)-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

2-{[2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2r,3r,4s,5r)-2-{[(1r,2s,3s)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

methyl 4-(furan-3-yl)-2,10-dimethyl-6-oxo-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,12-dioxatetracyclo[8.5.0.0²,⁷.0¹¹,¹³]pentadecane-11-carboxylate

C27H36O12 (552.2207)

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

C27H36O12 (552.2207)

2-{3-[2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2r,3r,4s,5r)-2-{[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

(2s,3r,4s,5s,6r)-2-{4-[(2s,3r,4s)-4-[(r)-(3,4-dimethoxyphenyl)(hydroxy)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

2-{[2-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-8-yl]-3-(4-methoxyphenyl)propan-1-one

C34H32O7 (552.2148)

methyl 8-[2-(furan-3-yl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-5-hydroxy-2,8-dimethyl-10-oxo-11-oxatricyclo[7.2.1.0²,⁷]dodec-3-ene-3-carboxylate

C27H36O12 (552.2207)

(2r,3s)-3-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-2-[(3-methoxy-4-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl]butanoic acid

C27H36O12 (552.2207)

(2r,3r,4s,5s,6r)-2-{[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

2-{[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-5-(hydroxymethyl)oxolane-3,4-diol

C27H36O12 (552.2207)

(4r,5r)-1,5-bis(3,4-dimethoxyphenyl)-5-hydroxy-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-1-one

C27H36O12 (552.2207)

(2r,3r,4s,5s,6r)-2-{3-[(2r,3s)-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]propoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2s)-4-[5,7-dihydroxy-8-(3-methylbut-2-en-1-yl)-2-oxo-4-phenylchromen-6-yl]-2-methyl-4-oxobutyl (2e)-3-phenylprop-2-enoate

C34H32O7 (552.2148)

1,5-bis(3,4-dimethoxyphenyl)-5-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-1-one

C27H36O12 (552.2207)

2-{[6-hydroxy-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

2,6,6-trimethyl-4-{[3,4,5-trihydroxy-6-({[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}cyclohex-1-ene-1-carboxylic acid

C27H36O12 (552.2207)

(2r,3s,4r,5r,6s)-2-{4-[(2r,3s,4s)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2,6-dimethoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

methyl (2s,4as,6s,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

methyl (2s,4as,6s,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

C27H36O12 (552.2207)

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(6s)-6-(hydroxymethyl)-5,5-dimethyl-3-oxocyclohex-1-en-1-yl]methoxy}oxan-2-yl]methyl (2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate

C27H36O12 (552.2207)

2-methylidene-3-oxobutyl (3e,5r)-5-[(1r,5r,6e,9z,13r,15r)-5-(acetyloxy)-10-chloro-6-methyl-3-oxo-2,14-dioxabicyclo[11.2.1]hexadeca-6,9-dien-15-yl]-5-hydroxy-3-methylpent-3-enoate

C28H37ClO9 (552.2126)

2-(4-{4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl}-2,6-dimethoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2s,3r,4r,5s)-2-{[(1r,2s,3s)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

(4r)-2,6,6-trimethyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}cyclohex-1-ene-1-carboxylic acid

C27H36O12 (552.2207)

[(2r,3s,4s,5r,6s)-6-{[(3ar,4ar,5r,7s,7as,9ar)-7-(acetyloxy)-5-methyl-3,8-dimethylidene-2-oxo-octahydroazuleno[6,5-b]furan-5-yl]oxy}-5-(acetyloxy)-3,4-dihydroxyoxan-2-yl]methyl acetate

C27H36O12 (552.2207)

(2r,3r,4s,5s,6r)-2-{[(2s,3s)-2-(4-hydroxy-3,5-dimethoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2r,3s,4s,5s)-2-{[(1s,2r,3r)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

2-(4-{1-hydroxy-2-[4-(3-hydroxyprop-1-en-1-yl)-2,6-dimethoxyphenoxy]propyl}-2-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)

(2r,3r,4r,5r)-2-{[(1r,2s,3s)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-5-(hydroxymethyl)oxolane-3,4-diol

C27H36O12 (552.2207)

1-[(2r,3s)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2e)-3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-8-yl]-3-(4-methoxyphenyl)propan-1-one

C34H32O7 (552.2148)

2-(hydroxymethyl)-6-{4-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2,6-dimethoxyphenoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

methyl (2s,4ar,6r,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

methyl (2s,4ar,6r,6ar,9r,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

C27H36O12 (552.2207)

(2s,3r,4s,5r)-2-{[(1r,2s,3s)-7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}oxane-3,4,5-triol

C27H36O12 (552.2207)

1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2e)-3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-8-yl]-3-(4-methoxyphenyl)propan-1-one

C34H32O7 (552.2148)

methyl (2s,4as,6s,6ar,9s,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

methyl (2s,4as,6s,6ar,9s,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

C27H36O12 (552.2207)

(4r,5s)-1,5-bis(3,4-dimethoxyphenyl)-5-hydroxy-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-1-one

C27H36O12 (552.2207)

methyl 2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

C27H36O12 (552.2207)

methyl (4ar,6ar,10as,10bs)-2-(furan-3-yl)-9-hydroxy-6a,10b-dimethyl-4-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,4ah,5h,6h,9h,10h,10ah-naphtho[2,1-c]pyran-7-carboxylate

C27H36O12 (552.2207)

2-{[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C27H36O12 (552.2207)