Exact Mass: 494.1777

Exact Mass Matches: 494.1777

Found 256 metabolites which its exact mass value is equals to given mass value 494.1777, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Harpagoside

(E)-3-phenylprop-2-enoic acid [(1S,4aS,5R,7S,7aS)-4a,5-dihydroxy-7-methyl-1-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] ester

C24H30O11 (494.1788)


Harpagoside is a terpene glycoside. Harpagoside is a natural product found in Verbascum lychnitis, Verbascum sinuatum, and other organisms with data available. See also: Harpagophytum procumbens root (part of); Harpagophytum zeyheri root (part of). Origin: Plant; SubCategory_DNP: Monoterpenoids, Iridoid monoterpenoids Harpagoside is isolated from Harpagophytum procumbens. Harpagoside has inhibitory effects on COX-1 and COX-2 activity and inhibits NO production[1]. Harpagoside is isolated from Harpagophytum procumbens. Harpagoside has inhibitory effects on COX-1 and COX-2 activity and inhibits NO production[1].

   

3,6,9,12-Tetraazatetradecanedioic acid, 3,6,9,12-tetrakis(carboxymethyl)-

3,6,9,12-Tetraazatetradecanedioic acid, 3,6,9,12-tetrakis(carboxymethyl)-

C18H30N4O12 (494.186)


D064449 - Sequestering Agents > D002614 - Chelating Agents

   

2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide

1-(2-((3-Carbamoyl-4-hydroxy)phenoxy)ethylamino)-3-(4-(1-methyl-4-trifluoromethyl-2-imidazoylyl)phenoxy)-2-propanol methanesulfonate

C23H25F3N4O5 (494.1777)


D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists

   

Harpagoside

4a,5-Dihydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4ah,5H,6H,7H,7ah-cyclopenta[c]pyran-7-yl 3-phenylprop-2-enoic acid

C24H30O11 (494.1788)


   
   

Syringopicroside

Syringopicroside

C24H30O11 (494.1788)


   
   

MCULE-5212075561

MCULE-5212075561

C24H30O11 (494.1788)


   

Carboline metabolite (C26H26N2O8)

Carboline metabolite (C26H26N2O8)

C26H26N2O8 (494.1689)


Annotation level-3

   

6-O-p-coumaroyl ajugol

6-O-p-coumaroyl ajugol

C24H30O11 (494.1788)


   

combretastatin A-1 2-beta-D-glucoside|combretastatin A-1 2-O-beta-D-glucopyranoside

combretastatin A-1 2-beta-D-glucoside|combretastatin A-1 2-O-beta-D-glucopyranoside

C24H30O11 (494.1788)


   

3beta-hydroxystilpnotomentolide-8-O-(5-acetoxysenecioate)

3beta-hydroxystilpnotomentolide-8-O-(5-acetoxysenecioate)

C24H30O11 (494.1788)


   

6-O-cinnamoylharpagide

6-O-cinnamoylharpagide

C24H30O11 (494.1788)


   

12,15-O,O-diacetyl-13,21-dihydroeurycomanone

12,15-O,O-diacetyl-13,21-dihydroeurycomanone

C24H30O11 (494.1788)


   

4-[4-(Tetra-O-acetyl-beta-D-glucopyranosyloxy)-phenyl]-butan-2-on|4-[4-(tetra-O-acetyl-beta-D-glucopyranosyloxy)-phenyl]-butan-2-one|raspberry ketone tetra-O-acetyl-beta-D-glucopyranoside

4-[4-(Tetra-O-acetyl-beta-D-glucopyranosyloxy)-phenyl]-butan-2-on|4-[4-(tetra-O-acetyl-beta-D-glucopyranosyloxy)-phenyl]-butan-2-one|raspberry ketone tetra-O-acetyl-beta-D-glucopyranoside

C24H30O11 (494.1788)


   

hypochoeroside B

hypochoeroside B

C24H30O11 (494.1788)


   

(5S)-1,7-bis-(3,4-dihydroxyphenyl)-5-hydroxyheptane-3-on-5-O-beta-D-xylopyranoside|oregonin

(5S)-1,7-bis-(3,4-dihydroxyphenyl)-5-hydroxyheptane-3-on-5-O-beta-D-xylopyranoside|oregonin

C24H30O11 (494.1788)


   

nagilactone C 7-O-beta-D-xylopyranoside

nagilactone C 7-O-beta-D-xylopyranoside

C24H30O11 (494.1788)


   

graminibibenzyl A

graminibibenzyl A

C24H30O11 (494.1788)


   

graminibibenzyl B

graminibibenzyl B

C24H30O11 (494.1788)


   

4-O-methylalbiflorin

4-O-methylalbiflorin

C24H30O11 (494.1788)


   
   

8alpha-(5-acetoxy senecioyloxy)-3-beta-hydroxy-10alphaH-hirsutinolide-13-O-acetate|8alpha-<5-acetoxy senecioyloxy>-3-beta-hydroxy-10alphaH-hirsutinolide-13-O-acetate

8alpha-(5-acetoxy senecioyloxy)-3-beta-hydroxy-10alphaH-hirsutinolide-13-O-acetate|8alpha-<5-acetoxy senecioyloxy>-3-beta-hydroxy-10alphaH-hirsutinolide-13-O-acetate

C24H30O11 (494.1788)


   

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

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

C19H34N4O7S2 (494.1869)


   

6-O-Cinnamoyl harpagide

6-O-Cinnamoyl harpagide

C24H30O11 (494.1788)


   

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

NCGC00384835-02![4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

C24H30O11 (494.1788)


   

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

NCGC00384835-01![4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

C24H30O11 (494.1788)


   

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate

C24H30O11 (494.1788)


   

Harpagoside_major

Harpagoside_major

C24H30O11 (494.1788)


   

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate_minor

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate_minor

C24H30O11 (494.1788)


   

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate_major

[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanoate_major

C24H30O11 (494.1788)


   

Harpagoside_57.6\\%

Harpagoside_57.6\\%

C24H30O11 (494.1788)


   

Cys Cys Asn Arg

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

C16H30N8O6S2 (494.173)


   

Cys Cys Arg Asn

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

C16H30N8O6S2 (494.173)


   

Cys Glu Phe Pro

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

C22H30N4O7S (494.1835)


   

Cys Glu Ile Met

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-4-{[(1S,2S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Cys Glu Leu Met

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

C19H34N4O7S2 (494.1869)


   

Cys Glu Met Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]-3-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Cys Glu Met Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]-4-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Cys Glu Pro Phe

(4S)-4-[(2R)-2-amino-3-sulfanylpropanamido]-5-[(2S)-2-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C22H30N4O7S (494.1835)


   

Cys Phe Glu Pro

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

C22H30N4O7S (494.1835)


   

Cys Phe Pro Glu

(2S)-2-{[(2S)-1-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C22H30N4O7S (494.1835)


   

Cys Ile Glu Met

(4S)-4-[(2S,3S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylpentanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Cys Ile Met Glu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-methylpentanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Cys Leu Glu Met

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

C19H34N4O7S2 (494.1869)


   

Cys Leu Met Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-methylpentanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Cys Met Glu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Cys Met Glu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Cys Met Ile Glu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-methylpentanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Cys Met Leu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-methylpentanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Cys Asn Cys Arg

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

C16H30N8O6S2 (494.173)


   

Cys Asn Arg Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-5-carbamimidamidopentanamido]-3-sulfanylpropanoic acid

C16H30N8O6S2 (494.173)


   

Cys Pro Glu Phe

(4S)-4-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}butanoic acid

C22H30N4O7S (494.1835)


   

Cys Pro Phe Glu

(2S)-2-[(2S)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanamido]pentanedioic acid

C22H30N4O7S (494.1835)


   

Cys Arg Cys Asn

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

C16H30N8O6S2 (494.173)


   

Cys Arg Asn Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]-3-carbamoylpropanamido]-3-sulfanylpropanoic acid

C16H30N8O6S2 (494.173)


   

Asp Glu Met Thr

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

C18H30N4O10S (494.1683)


   

Asp Glu Thr Met

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

C18H30N4O10S (494.1683)


   

Asp His His Ser

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

C19H26N8O8 (494.1874)


   

Asp His Ser His

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

C19H26N8O8 (494.1874)


   

Asp Met Glu Thr

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

C18H30N4O10S (494.1683)


   

Asp Met Met Val

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

C19H34N4O7S2 (494.1869)


   

Asp Met Thr Glu

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

C18H30N4O10S (494.1683)


   

Asp Met Val Met

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

C19H34N4O7S2 (494.1869)


   

Asp Ser His His

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

C19H26N8O8 (494.1874)


   

Asp Thr Glu Met

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

C18H30N4O10S (494.1683)


   

Asp Thr Met Glu

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

C18H30N4O10S (494.1683)


   

Asp Val Met Met

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

C19H34N4O7S2 (494.1869)


   

Glu Cys Phe Pro

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

C22H30N4O7S (494.1835)


   

Glu Cys Ile Met

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

C19H34N4O7S2 (494.1869)


   

Glu Cys Leu Met

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

C19H34N4O7S2 (494.1869)


   

Glu Cys Met Ile

(2S,3S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Glu Cys Met Leu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Glu Cys Pro Phe

(4S)-4-amino-4-{[(2R)-1-[(2S)-2-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-sulfanylpropan-2-yl]carbamoyl}butanoic acid

C22H30N4O7S (494.1835)


   

Glu Asp Met Thr

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

C18H30N4O10S (494.1683)


   

Glu Asp Thr Met

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

C18H30N4O10S (494.1683)


   

Glu Glu Met Ser

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

C18H30N4O10S (494.1683)


   

Glu Glu Ser Met

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

C18H30N4O10S (494.1683)


   

Glu Phe Cys Pro

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

C22H30N4O7S (494.1835)


   

Glu Phe Pro Cys

(4S)-4-amino-4-{[(2S)-1-[(2S)-2-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamoyl}butanoic acid

C22H30N4O7S (494.1835)


   

Glu Ile Cys Met

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

C19H34N4O7S2 (494.1869)


   

Glu Ile Met Cys

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

C19H34N4O7S2 (494.1869)


   

Glu Leu Cys Met

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

C19H34N4O7S2 (494.1869)


   

Glu Leu Met Cys

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

C19H34N4O7S2 (494.1869)


   

Glu Met Cys Ile

(2S,3S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Glu Met Cys Leu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Glu Met Asp Thr

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

C18H30N4O10S (494.1683)


   

Glu Met Glu Ser

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

C18H30N4O10S (494.1683)


   

Glu Met Ile Cys

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

C19H34N4O7S2 (494.1869)


   

Glu Met Leu Cys

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

C19H34N4O7S2 (494.1869)


   

Glu Met Ser Glu

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

C18H30N4O10S (494.1683)


   

Glu Met Thr Asp

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

C18H30N4O10S (494.1683)


   

Glu Pro Cys Phe

(4S)-4-amino-5-[(2S)-2-{[(1R)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C22H30N4O7S (494.1835)


   

Glu Pro Phe Cys

(4S)-4-amino-5-[(2S)-2-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-phenylethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C22H30N4O7S (494.1835)


   

Glu Ser Glu Met

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

C18H30N4O10S (494.1683)


   

Glu Ser Met Glu

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

C18H30N4O10S (494.1683)


   

Glu Thr Asp Met

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

C18H30N4O10S (494.1683)


   

Glu Thr Met Asp

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

C18H30N4O10S (494.1683)


   

Phe Cys Glu Pro

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

C22H30N4O7S (494.1835)


   

Phe Cys Pro Glu

(2S)-2-{[(2S)-1-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C22H30N4O7S (494.1835)


   

Phe Glu Cys Pro

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

C22H30N4O7S (494.1835)


   

Phe Glu Pro Cys

(4S)-4-[(2S)-2-amino-3-phenylpropanamido]-5-[(2S)-2-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C22H30N4O7S (494.1835)


   

Phe Pro Cys Glu

(2S)-2-[(2R)-2-{[(2S)-1-[(2S)-2-amino-3-phenylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]pentanedioic acid

C22H30N4O7S (494.1835)


   

Phe Pro Glu Cys

(4S)-4-{[(2S)-1-[(2S)-2-amino-3-phenylpropanoyl]pyrrolidin-2-yl]formamido}-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C22H30N4O7S (494.1835)


   

His Asp His Ser

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

C19H26N8O8 (494.1874)


   

His Asp Ser His

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

C19H26N8O8 (494.1874)


   

His His Asp Ser

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

C19H26N8O8 (494.1874)


   

His His Ser Asp

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

C19H26N8O8 (494.1874)


   

His Ser Asp His

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

C19H26N8O8 (494.1874)


   

His Ser His Asp

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

C19H26N8O8 (494.1874)


   

Ile Cys Glu Met

(4S)-4-[(2R)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-sulfanylpropanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Ile Cys Met Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Ile Glu Cys Met

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

C19H34N4O7S2 (494.1869)


   

Ile Glu Met Cys

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

C19H34N4O7S2 (494.1869)


   

Ile Met Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Ile Met Glu Cys

(4S)-4-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-(methylsulfanyl)butanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Leu Cys Glu Met

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

C19H34N4O7S2 (494.1869)


   

Leu Cys Met Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-methylpentanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Leu Glu Cys Met

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

C19H34N4O7S2 (494.1869)


   

Leu Glu Met Cys

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

C19H34N4O7S2 (494.1869)


   

Leu Met Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Leu Met Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-(methylsulfanyl)butanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Met Cys Glu Ile

(2S,3S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Met Cys Glu Leu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Met Cys Ile Glu

(2S)-2-[(2S,3S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-methylpentanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Met Cys Leu Glu

(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-methylpentanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Met Asp Glu Thr

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

C18H30N4O10S (494.1683)


   

Met Asp Met Val

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

C19H34N4O7S2 (494.1869)


   

Met Asp Thr Glu

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

C18H30N4O10S (494.1683)


   

Met Asp Val Met

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

C19H34N4O7S2 (494.1869)


   

Met Glu Cys Ile

(2S,3S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-3-sulfanylpropanamido]-3-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Met Glu Cys Leu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-3-sulfanylpropanamido]-4-methylpentanoic acid

C19H34N4O7S2 (494.1869)


   

Met Glu Asp Thr

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

C18H30N4O10S (494.1683)


   

Met Glu Glu Ser

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

C18H30N4O10S (494.1683)


   

Met Glu Ile Cys

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-{[(1S,2S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Met Glu Leu Cys

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-3-methylbutyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Met Glu Ser Glu

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

C18H30N4O10S (494.1683)


   

Met Glu Thr Asp

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

C18H30N4O10S (494.1683)


   

Met Ile Cys Glu

(2S)-2-[(2R)-2-[(2S,3S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-methylpentanamido]-3-sulfanylpropanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Met Ile Glu Cys

(4S)-4-[(2S,3S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-methylpentanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Met Leu Cys Glu

(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-methylpentanamido]-3-sulfanylpropanamido]pentanedioic acid

C19H34N4O7S2 (494.1869)


   

Met Leu Glu Cys

(4S)-4-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-methylpentanamido]-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}butanoic acid

C19H34N4O7S2 (494.1869)


   

Met Met Asp Val

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

C19H34N4O7S2 (494.1869)


   

Met Met Val Asp

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

C19H34N4O7S2 (494.1869)


   

Met Ser Glu Glu

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

C18H30N4O10S (494.1683)


   

Met Thr Asp Glu

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

C18H30N4O10S (494.1683)


   

Met Thr Glu Asp

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

C18H30N4O10S (494.1683)


   

Met Val Asp Met

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

C19H34N4O7S2 (494.1869)


   

Met Val Met Asp

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

C19H34N4O7S2 (494.1869)


   

Asn Cys Cys Arg

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

C16H30N8O6S2 (494.173)


   

Asn Cys Arg Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]-3-sulfanylpropanoic acid

C16H30N8O6S2 (494.173)


   

Asn Arg Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C16H30N8O6S2 (494.173)


   

Pro Cys Glu Phe

(4S)-4-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-4-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]butanoic acid

C22H30N4O7S (494.1835)


   

Pro Cys Phe Glu

(2S)-2-[(2S)-3-phenyl-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]propanamido]pentanedioic acid

C22H30N4O7S (494.1835)


   

Pro Glu Cys Phe

(4S)-4-{[(1R)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C22H30N4O7S (494.1835)


   

Pro Glu Phe Cys

(4S)-4-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-phenylethyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C22H30N4O7S (494.1835)


   

Pro Phe Cys Glu

(2S)-2-[(2R)-2-[(2S)-3-phenyl-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-3-sulfanylpropanamido]pentanedioic acid

C22H30N4O7S (494.1835)


   

Pro Phe Glu Cys

(4S)-4-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-4-[(2S)-3-phenyl-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]butanoic acid

C22H30N4O7S (494.1835)


   

Arg Cys Cys Asn

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

C16H30N8O6S2 (494.173)


   

Arg Cys Asn Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-sulfanylpropanoic acid

C16H30N8O6S2 (494.173)


   

Arg Asn Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-carbamoylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C16H30N8O6S2 (494.173)


   

Ser Asp His His

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

C19H26N8O8 (494.1874)


   

Ser Glu Glu Met

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

C18H30N4O10S (494.1683)


   

Ser Glu Met Glu

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

C18H30N4O10S (494.1683)


   

Ser His Asp His

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

C19H26N8O8 (494.1874)


   

Ser His His Asp

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

C19H26N8O8 (494.1874)


   

Ser Met Glu Glu

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

C18H30N4O10S (494.1683)


   

Thr Asp Glu Met

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

C18H30N4O10S (494.1683)


   

Thr Asp Met Glu

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

C18H30N4O10S (494.1683)


   

Thr Glu Asp Met

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

C18H30N4O10S (494.1683)


   

Thr Glu Met Asp

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

C18H30N4O10S (494.1683)


   

Thr Met Asp Glu

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

C18H30N4O10S (494.1683)


   

Thr Met Glu Asp

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

C18H30N4O10S (494.1683)


   

Val Asp Met Met

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

C19H34N4O7S2 (494.1869)


   

Val Met Asp Met

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

C19H34N4O7S2 (494.1869)


   

Val Met Met Asp

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

C19H34N4O7S2 (494.1869)


   

TyrMe-TyrMe-OH

(S)-2-(3-(4-methoxyphenethoxy)-4-nitrobenzamido)-4-(4-methoxyphenyl)butanoic acid

C26H26N2O8 (494.1689)


   

4-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)benzyl 2,3-dihydroxy-2-(4-hydroxybenzyl)butanoate

4-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)benzyl 2,3-dihydroxy-2-(4-hydroxybenzyl)butanoate

C24H30O11 (494.1788)


   

WZ4002

N-(3-(5-chloro-2-(2-methoxy-4-(4-methylpiperazin-1-yl)phenylamino)pyrimidin-4-yloxy)phenyl)acrylamide

C25H27ClN6O3 (494.1833)


D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors

   

Z-Gly-Gly-Gly-Gly-Gly-Gly-OH

Z-Gly-Gly-Gly-Gly-Gly-Gly-OH

C20H26N6O9 (494.1761)


   

Toceranib phosphate

Toceranib phosphate

C22H28FN4O6P (494.173)


C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor

   

d-pantothenic acid calcium salt hydrate

d-pantothenic acid calcium salt hydrate

C18H34CaN2O11 (494.1788)


   

Pigment Red 195

Pigment Red 195

C32H22N4O2 (494.1743)


   

(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(E)-N-hydroxy-C-(7-methylsulfanylheptyl)carbonimidoyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(E)-N-hydroxy-C-(7-methylsulfanylheptyl)carbonimidoyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

C19H34N4O7S2 (494.1869)


   

4-[3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-2-(methoxycarbonylamino)butanoic acid

4-[3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-2-(methoxycarbonylamino)butanoic acid

C20H26N6O9 (494.1761)


   

Curvifloruside F

Curvifloruside F

C24H30O11 (494.1788)


   

15-O-propionylbruceolide

15-O-propionylbruceolide

C24H30O11 (494.1788)


A quassinoid that is the 15-O-propionyl derivative of bruceolide. It has been isolated from Brucea javanica and Brucea sumatrana.

   

N-[4-[cyano-[3-[2-(4-morpholinyl)ethylamino]-2-quinoxalinyl]methyl]sulfonylphenyl]acetamide

N-[4-[cyano-[3-[2-(4-morpholinyl)ethylamino]-2-quinoxalinyl]methyl]sulfonylphenyl]acetamide

C24H26N6O4S (494.1736)


   

2-[(3S,6aS,8R,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3S,6aS,8R,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

[(8S,9R,10S)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9R,10S)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C27H30N2O3S2 (494.1698)


   

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

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

C22H30N4O7S (494.1835)


   

2-[(3S,6aR,8R,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3S,6aR,8R,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

2-[(3R,6aS,8R,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3R,6aS,8R,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

2-[(3S,6aS,8S,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3S,6aS,8S,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

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

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

C22H30N4O7S (494.1835)


   

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

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

C22H30N4O7S (494.1835)


   

2-[(3R,6aR,8S,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3R,6aR,8S,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

(3R)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxylic acid

(3R)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxylic acid

C27H30N2O5S (494.1875)


   

[(8R,9S,10S)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9S,10S)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C27H30N2O3S2 (494.1698)


   

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

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

C22H30N4O7S (494.1835)


   

[(8S,9S,10R)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9S,10R)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C27H30N2O3S2 (494.1698)


   

[(8R,9R,10S)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9R,10S)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C27H30N2O3S2 (494.1698)


   

[(8S,9R,10R)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9R,10R)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C27H30N2O3S2 (494.1698)


   

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

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

C22H30N4O7S (494.1835)


   

2-[(3R,6aS,8S,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3R,6aS,8S,10aS)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

2-[(3S,6aR,8S,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3S,6aR,8S,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

2-[(3R,6aR,8R,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(3R,6aR,8R,10aR)-1-[(2,5-difluorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-chlorophenyl)methyl]acetamide

C25H29ClF2N2O4 (494.1784)


   

[(8R,9S,10R)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9S,10R)-9-[4-[(E)-2-phenylethenyl]phenyl]-6-thiophen-2-ylsulfonyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C27H30N2O3S2 (494.1698)


   

(3S)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxylic acid

(3S)-2-tert-butylsulfinyl-3-(2-hydroxyethyl)-4-[3-(3-methoxyphenyl)phenyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxylic acid

C27H30N2O5S (494.1875)


   

4-(3,4-Dimethoxybenzoyl)-5-(4-ethoxy-3-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione

4-(3,4-Dimethoxybenzoyl)-5-(4-ethoxy-3-methoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione

C26H26N2O8 (494.1689)


   

3,4,5-trihydroxy-6-[(14-hydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-16-yl)oxy]oxane-2-carboxylic acid

3,4,5-trihydroxy-6-[(14-hydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-16-yl)oxy]oxane-2-carboxylic acid

C24H30O11 (494.1788)


   

[(4aS,5R,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-phenylprop-2-enoate

[(4aS,5R,7aS)-4a,5-dihydroxy-7-methyl-1-[(2S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5,6,7a-tetrahydrocyclopenta[c]pyran-7-yl] (E)-3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide

2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenoxy]propyl]amino]ethoxy]benzamide

C23H25F3N4O5 (494.1777)


D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists

   
   
   

ST 18:4;O5;GlcA

ST 18:4;O5;GlcA

C24H30O11 (494.1788)


   

ST 18:5;O6;Hex

ST 18:5;O6;Hex

C24H30O11 (494.1788)


   
   

3-hydroxy-2-{[(1e)-5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-[(2-oxo-2-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}ethyl)amino]cyclohex-2-en-1-ylidene]amino}propanoic acid

3-hydroxy-2-{[(1e)-5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-[(2-oxo-2-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}ethyl)amino]cyclohex-2-en-1-ylidene]amino}propanoic acid

C19H30N2O13 (494.1748)


   

19-ethenyl-25,26-dihydroxy-24-(hydroxymethyl)-21,23,28,29-tetraoxa-4,14-diazaheptacyclo[18.8.1.0²,¹⁸.0⁴,¹⁶.0⁷,¹⁵.0⁸,¹³.0²²,²⁷]nonacosa-2(18),7(15),8,10,12,16-hexaen-3-one

19-ethenyl-25,26-dihydroxy-24-(hydroxymethyl)-21,23,28,29-tetraoxa-4,14-diazaheptacyclo[18.8.1.0²,¹⁸.0⁴,¹⁶.0⁷,¹⁵.0⁸,¹³.0²²,²⁷]nonacosa-2(18),7(15),8,10,12,16-hexaen-3-one

C26H26N2O8 (494.1689)


   

12-[(acetyloxy)methyl]-5-hydroxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-11-en-10-yl 4-(acetyloxy)-3-methylbut-2-enoate

12-[(acetyloxy)methyl]-5-hydroxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-11-en-10-yl 4-(acetyloxy)-3-methylbut-2-enoate

C24H30O11 (494.1788)


   

4-O-methylpaeoniflorin

NA

C24H30O11 (494.1788)


{"Ingredient_id": "HBIN010793","Ingredient_name": "4-O-methylpaeoniflorin","Alias": "NA","Ingredient_formula": "C24H30O11","Ingredient_Smile": "CC12CC3(C4CC1(C4(C(O2)O3)COC(=O)C5=CC=CC=C5)OC6C(C(C(C(O6)CO)O)O)O)OC","Ingredient_weight": "494.5 g/mol","OB_score": "25.70632536","CAS_id": "NA","SymMap_id": "SMIT08816","TCMID_id": "33122","TCMSP_id": "MOL007368","TCM_ID_id": "NA","PubChem_id": "46882921","DrugBank_id": "NA"}

   

4-o-methyl-paeoniflorin

NA

C24H30O11 (494.1788)


{"Ingredient_id": "HBIN010794","Ingredient_name": "4-o-methyl-paeoniflorin","Alias": "NA","Ingredient_formula": "C24H30O11","Ingredient_Smile": "CC12CC3(C4CC1(C4(C(O2)O3)COC(=O)C5=CC=CC=C5)OC6C(C(C(C(O6)CO)O)O)O)OC","Ingredient_weight": "494.5 g/mol","OB_score": "25.70632536","CAS_id": "NA","SymMap_id": "SMIT08529","TCMID_id": "NA","TCMSP_id": "MOL007011","TCM_ID_id": "NA","PubChem_id": "46882921","DrugBank_id": "NA"}

   

ajugol; 6-o-(4-hydroxy-e-cinnamoyl)

NA

C24H30O11 (494.1788)


{"Ingredient_id": "HBIN014996","Ingredient_name": "ajugol; 6-o-(4-hydroxy-e-cinnamoyl)","Alias": "NA","Ingredient_formula": "C24H30O11","Ingredient_Smile": "NA","Ingredient_weight": "494.49","OB_score": "NA","CAS_id": "124168-05-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7087","PubChem_id": "NA","DrugBank_id": "NA"}

   

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

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

C24H30O11 (494.1788)


   

(1s,19r,20s,22s,24r,25s,26s,27r)-19-ethenyl-25,26-dihydroxy-24-(hydroxymethyl)-21,23,28,29-tetraoxa-4,14-diazaheptacyclo[18.8.1.0²,¹⁸.0⁴,¹⁶.0⁷,¹⁵.0⁸,¹³.0²²,²⁷]nonacosa-2(18),7(15),8,10,12,16-hexaen-3-one

(1s,19r,20s,22s,24r,25s,26s,27r)-19-ethenyl-25,26-dihydroxy-24-(hydroxymethyl)-21,23,28,29-tetraoxa-4,14-diazaheptacyclo[18.8.1.0²,¹⁸.0⁴,¹⁶.0⁷,¹⁵.0⁸,¹³.0²²,²⁷]nonacosa-2(18),7(15),8,10,12,16-hexaen-3-one

C26H26N2O8 (494.1689)


   

6-({[2-(dimethylamino)-3-hydroxypropanoyl]oxy}methyl)-n-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-9-methoxyphenazine-1-carboximidic acid

6-({[2-(dimethylamino)-3-hydroxypropanoyl]oxy}methyl)-n-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-9-methoxyphenazine-1-carboximidic acid

C25H26N4O7 (494.1801)


   

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

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

C24H30O11 (494.1788)


   

(1s,4as,5s,7s,7as)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl (2e)-3-phenylprop-2-enoate

(1s,4as,5s,7s,7as)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl (2e)-3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

(5-hydroxy-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]decan-2-yl)methyl 3-phenylprop-2-enoate

(5-hydroxy-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]decan-2-yl)methyl 3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

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

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

C24H30O11 (494.1788)


   

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

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

C24H30O11 (494.1788)


   

(4-methoxy-6-methyl-8-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,⁹]nonan-9-yl)methyl benzoate

(4-methoxy-6-methyl-8-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,⁹]nonan-9-yl)methyl benzoate

C24H30O11 (494.1788)


   

(1r,4r,5r,6s,7r,8r,11r,13s,17s,18s,19r)-8-(acetyloxy)-4,7,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-5-yl acetate

(1r,4r,5r,6s,7r,8r,11r,13s,17s,18s,19r)-8-(acetyloxy)-4,7,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-5-yl acetate

C24H30O11 (494.1788)


   

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

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

C24H30O11 (494.1788)


   

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

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

C24H30O11 (494.1788)


   

(8-methoxy-6-methyl-4-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,⁹]nonan-9-yl)methyl benzoate

(8-methoxy-6-methyl-4-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,⁹]nonan-9-yl)methyl benzoate

C24H30O11 (494.1788)


   

4,4',7'-trimethoxy-9,10-dihydro-[1,1'-biphenanthrene]-2,2',7-triol

4,4',7'-trimethoxy-9,10-dihydro-[1,1'-biphenanthrene]-2,2',7-triol

C31H26O6 (494.1729)


   

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

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

C24H30O11 (494.1788)


   

[(1s,2s,4s,5s,6r,10s)-5-hydroxy-10-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]decan-2-yl]methyl (2z)-3-phenylprop-2-enoate

[(1s,2s,4s,5s,6r,10s)-5-hydroxy-10-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]decan-2-yl]methyl (2z)-3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

(1s,2r,4r,5s,8s,10s)-12-[(acetyloxy)methyl]-5-hydroxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-11-en-10-yl (2z)-4-(acetyloxy)-3-methylbut-2-enoate

(1s,2r,4r,5s,8s,10s)-12-[(acetyloxy)methyl]-5-hydroxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-11-en-10-yl (2z)-4-(acetyloxy)-3-methylbut-2-enoate

C24H30O11 (494.1788)


   

4',5,7'-trimethoxy-9,10-dihydro-[1,1'-biphenanthrene]-2,2',7-triol

4',5,7'-trimethoxy-9,10-dihydro-[1,1'-biphenanthrene]-2,2',7-triol

C31H26O6 (494.1729)


   

(2e)-6-[(acetyloxy)methyl]-11,13-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl 4-(acetyloxy)-3-methylbut-2-enoate

(2e)-6-[(acetyloxy)methyl]-11,13-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl 4-(acetyloxy)-3-methylbut-2-enoate

C24H30O11 (494.1788)


   

[(1r,3r,4r,6s)-4-hydroxy-4,6-dimethyl-8-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,⁹]nonan-9-yl]methyl benzoate

[(1r,3r,4r,6s)-4-hydroxy-4,6-dimethyl-8-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,⁹]nonan-9-yl]methyl benzoate

C24H30O11 (494.1788)


   

8-(acetyloxy)-4,7,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-5-yl acetate

8-(acetyloxy)-4,7,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-5-yl acetate

C24H30O11 (494.1788)


   

[(1s,2s,4s,5s,6r,10s)-5-hydroxy-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]decan-2-yl]methyl (2e)-3-phenylprop-2-enoate

[(1s,2s,4s,5s,6r,10s)-5-hydroxy-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]decan-2-yl]methyl (2e)-3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

3-hydroxy-2-{[5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-[(2-oxo-2-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}ethyl)imino]cyclohex-1-en-1-yl]amino}propanoic acid

3-hydroxy-2-{[5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-[(2-oxo-2-{[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}ethyl)imino]cyclohex-1-en-1-yl]amino}propanoic acid

C19H30N2O13 (494.1748)


   

(1s,4as,5r,7s,7as)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl (2z)-3-phenylprop-2-enoate

(1s,4as,5r,7s,7as)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl (2z)-3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

6-({[(2s)-2-(dimethylamino)-3-hydroxypropanoyl]oxy}methyl)-n-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-9-methoxyphenazine-1-carboximidic acid

6-({[(2s)-2-(dimethylamino)-3-hydroxypropanoyl]oxy}methyl)-n-(2-hydroxy-5-oxocyclopent-1-en-1-yl)-9-methoxyphenazine-1-carboximidic acid

C25H26N4O7 (494.1801)


   

(1r,2e,8s,10s,11r,13s)-6-[(acetyloxy)methyl]-11,13-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl (2z)-4-(acetyloxy)-3-methylbut-2-enoate

(1r,2e,8s,10s,11r,13s)-6-[(acetyloxy)methyl]-11,13-dihydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl (2z)-4-(acetyloxy)-3-methylbut-2-enoate

C24H30O11 (494.1788)


   

[(1r,2s,3s,5s,6r,8s)-6-methoxy-8-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(1r,2s,3s,5s,6r,8s)-6-methoxy-8-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C24H30O11 (494.1788)


   

[6-({4a,5,7-trihydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-1-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3-phenylprop-2-enoate

[6-({4a,5,7-trihydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-1-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3-phenylprop-2-enoate

C24H30O11 (494.1788)


   

(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 (2e)-3-(4-hydroxyphenyl)prop-2-enoate

(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 (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C24H30O11 (494.1788)


   

4,7,7'-trimethoxy-9',10'-dihydro-[1,3'-biphenanthrene]-2,2',5'-triol

4,7,7'-trimethoxy-9',10'-dihydro-[1,3'-biphenanthrene]-2,2',5'-triol

C31H26O6 (494.1729)


   

(1s,2s,4r,5s,8s,10s)-12-[(acetyloxy)methyl]-5-hydroxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-11-en-10-yl (2z)-4-(acetyloxy)-3-methylbut-2-enoate

(1s,2s,4r,5s,8s,10s)-12-[(acetyloxy)methyl]-5-hydroxy-4,8-dimethyl-7,13-dioxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-11-en-10-yl (2z)-4-(acetyloxy)-3-methylbut-2-enoate

C24H30O11 (494.1788)


   

7-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 3-(4-hydroxyphenyl)prop-2-enoate

7-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-5-yl 3-(4-hydroxyphenyl)prop-2-enoate

C24H30O11 (494.1788)