Exact Mass: 462.2366

Exact Mass Matches: 462.2366

Found 216 metabolites which its exact mass value is equals to given mass value 462.2366, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Neryl rhamnosyl-glucoside

2-[(6-{[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


Constituent of wine grapes (Vitis vinifera). Geranyl rhamnosyl-glucoside is found in alcoholic beverages, fruits, and common grape. Neryl rhamnosyl-glucoside is found in alcoholic beverages. Neryl rhamnosyl-glucoside is isolated from wine grapes (Vitis vinifera

   

xi-Linalool 3-[rhamnosyl-(1->6)-glucoside]

2-({6-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


xi-Linalool 3-[rhamnosyl-(1->6)-glucoside] is found in alcoholic beverages. xi-Linalool 3-[rhamnosyl-(1->6)-glucoside] is a constituent of wine grapes (Vitis vinifera) Constituent of wine grapes (Vitis vinifera). xi-Linalool 3-[rhamnosyl-(1->6)-glucoside] is found in alcoholic beverages, fruits, and common grape.

   

Vistusertib

3-[2,4-bis(3-methylmorpholin-4-yl)pyrido[2,3-d]pyrimidin-7-yl]-N-methylbenzamide

C25H30N6O3 (462.2379)


   

Sar-Pro-Arg-pNA

5-[(diaminomethylidene)amino]-2-({1-[2-(methylamino)acetyl]pyrrolidin-2-yl}formamido)-N-(4-nitrophenyl)pentanamide

C20H30N8O5 (462.2339)


   

SCHEMBL13960539

5-Methyl-8-(4-methylpiperazin-1-yl)-N-[4-(morpholin-4-yl)phenyl]-4-oxo-4H-chromene-2-carboximidate

C26H30N4O4 (462.2267)


   

Ligurobustoside A

Ligurobustoside A

C22H38O10 (462.2465)


   

Mulberrofuran X

Mulberrofuran X

C29H34O5 (462.2406)


   

SCHEMBL6828

SCHEMBL6828

C26H38O5S (462.244)


   

2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

C22H38O10 (462.2465)


   

(2RS,3SR)-3,4-dihydro-7-(6-hydroxybenzofuran-2-yl)-2-methyl-6-(3-methylbut-2-enyl)-2-(4-methylpent-3-enyl)-2H-1-benzopyran-3,5-diol|artopetelin F

(2RS,3SR)-3,4-dihydro-7-(6-hydroxybenzofuran-2-yl)-2-methyl-6-(3-methylbut-2-enyl)-2-(4-methylpent-3-enyl)-2H-1-benzopyran-3,5-diol|artopetelin F

C29H34O5 (462.2406)


   

(2R)-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-5,7-bis(3-methylbut-2-en-1-yl)-2,4-bi-1-benzofuran-6,6-diol|artonitidin A

(2R)-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-5,7-bis(3-methylbut-2-en-1-yl)-2,4-bi-1-benzofuran-6,6-diol|artonitidin A

C29H34O5 (462.2406)


   
   

fascioquinol E

fascioquinol E

C26H38O5S (462.244)


   
   

Lipedoside B-I

Lipedoside B-I

C22H38O10 (462.2465)


   

artocarpol I|rel-(17R,18R)-3,4-dihydro-2-methyl-6-(3-methylbut-2-enyl)-2-(4-methylpent-3-enyl)-2H-dibenzo[b.f]pyrano[2,3-d]oxepine-3alpha,7,11-triol

artocarpol I|rel-(17R,18R)-3,4-dihydro-2-methyl-6-(3-methylbut-2-enyl)-2-(4-methylpent-3-enyl)-2H-dibenzo[b.f]pyrano[2,3-d]oxepine-3alpha,7,11-triol

C29H34O5 (462.2406)


   

Artopetelin C

Artopetelin C

C29H34O5 (462.2406)


   

walsucochinoid E

walsucochinoid E

C29H34O5 (462.2406)


   

Virgataxanthone A

Virgataxanthone A

C29H34O5 (462.2406)


   

Artopetelin H

Artopetelin H

C29H34O5 (462.2406)


   

fascioquinol A

fascioquinol A

C26H38O5S (462.244)


   

salacia quinonemethide|Salaciachinomethid

salacia quinonemethide|Salaciachinomethid

C29H34O5 (462.2406)


   

2-[2-(3,3-dimethyloxiran-2-yl)ethyl]-3,4-dihydro-6-(3-methylbut-2-enyl)-2H-dibenzo[b,f]pyrano[2,3-d]oxepin-7,11-diol|artocarpol G

2-[2-(3,3-dimethyloxiran-2-yl)ethyl]-3,4-dihydro-6-(3-methylbut-2-enyl)-2H-dibenzo[b,f]pyrano[2,3-d]oxepin-7,11-diol|artocarpol G

C29H34O5 (462.2406)


   

Artopetelin K

Artopetelin K

C29H34O5 (462.2406)


   
   

Artopetelin E

Artopetelin E

C29H34O5 (462.2406)


   

Artopetelin D

Artopetelin D

C29H34O5 (462.2406)


   

1,7-dihydroxy-3-methoxy-2-isoprenyl-4-geranylxanthone|pruniflorone L

1,7-dihydroxy-3-methoxy-2-isoprenyl-4-geranylxanthone|pruniflorone L

C29H34O5 (462.2406)


   
   
   
   

C22H38O10_2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside

NCGC00380554-01_C22H38O10_2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside

C22H38O10 (462.2465)


   

Ala His His Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanoic acid

C20H30N8O5 (462.2339)


   

Ala His Val His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Ala Val His His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Cys Gly Lys Arg

(2S)-2-[(2S)-6-amino-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}hexanamido]-5-carbamimidamidopentanoic acid

C17H34N8O5S (462.2373)


   

Cys Gly Arg Lys

(2S)-6-amino-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-5-carbamimidamidopentanamido]hexanoic acid

C17H34N8O5S (462.2373)


   

Cys Lys Gly Arg

(2S)-2-{2-[(2S)-6-amino-2-[(2R)-2-amino-3-sulfanylpropanamido]hexanamido]acetamido}-5-carbamimidamidopentanoic acid

C17H34N8O5S (462.2373)


   

Cys Lys Arg Gly

2-[(2S)-2-[(2S)-6-amino-2-[(2R)-2-amino-3-sulfanylpropanamido]hexanamido]-5-carbamimidamidopentanamido]acetic acid

C17H34N8O5S (462.2373)


   

Cys Arg Gly Lys

(2S)-6-amino-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]acetamido}hexanoic acid

C17H34N8O5S (462.2373)


   

Cys Arg Lys Gly

2-[(2S)-6-amino-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]hexanamido]acetic acid

C17H34N8O5S (462.2373)


   

Glu Ile Thr Thr

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

C19H34N4O9 (462.2326)


   

Glu Leu Thr Thr

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

C19H34N4O9 (462.2326)


   

Glu Thr Ile Thr

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

C19H34N4O9 (462.2326)


   

Glu Thr Leu Thr

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

C19H34N4O9 (462.2326)


   

Glu Thr Thr Ile

(2S,3S)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]-3-methylpentanoic acid

C19H34N4O9 (462.2326)


   

Glu Thr Thr Leu

(2S)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2-amino-4-carboxybutanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]-4-methylpentanoic acid

C19H34N4O9 (462.2326)


   

Gly Cys Lys Arg

(2S)-2-[(2S)-6-amino-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]hexanamido]-5-carbamimidamidopentanoic acid

C17H34N8O5S (462.2373)


   

Gly Cys Arg Lys

(2S)-6-amino-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]hexanoic acid

C17H34N8O5S (462.2373)


   

Gly His His Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanoic acid

C20H30N8O5 (462.2339)


   

Gly His His Leu

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanoic acid

C20H30N8O5 (462.2339)


   

Gly His Ile His

(2S)-2-[(2S,3S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Gly His Leu His

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Gly Ile His His

(2S)-2-[(2S)-2-[(2S,3S)-2-(2-aminoacetamido)-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Gly Lys Cys Arg

(2S)-2-[(2R)-2-[(2S)-6-amino-2-(2-aminoacetamido)hexanamido]-3-sulfanylpropanamido]-5-carbamimidamidopentanoic acid

C17H34N8O5S (462.2373)


   

Gly Lys Arg Cys

(2R)-2-[(2S)-2-[(2S)-6-amino-2-(2-aminoacetamido)hexanamido]-5-carbamimidamidopentanamido]-3-sulfanylpropanoic acid

C17H34N8O5S (462.2373)


   

Gly Leu His His

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Gly Arg Cys Lys

(2S)-6-amino-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]hexanoic acid

C17H34N8O5S (462.2373)


   

Gly Arg Lys Cys

(2R)-2-[(2S)-6-amino-2-[(2S)-2-(2-aminoacetamido)-5-carbamimidamidopentanamido]hexanamido]-3-sulfanylpropanoic acid

C17H34N8O5S (462.2373)


   

His Ala His Val

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

C20H30N8O5 (462.2339)


   

His Ala Val His

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

C20H30N8O5 (462.2339)


   

His Gly His Ile

(2S,3S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanoic acid

C20H30N8O5 (462.2339)


   

His Gly His Leu

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanoic acid

C20H30N8O5 (462.2339)


   

His Gly Ile His

(2S)-2-[(2S,3S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

His Gly Leu His

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

His His Ala Val

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

C20H30N8O5 (462.2339)


   

His His Gly Ile

(2S,3S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-methylpentanoic acid

C20H30N8O5 (462.2339)


   

His His Gly Leu

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}-4-methylpentanoic acid

C20H30N8O5 (462.2339)


   

His His Ile Gly

2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]acetic acid

C20H30N8O5 (462.2339)


   

His His Leu Gly

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

C20H30N8O5 (462.2339)


   

His His Val Ala

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

C20H30N8O5 (462.2339)


   

His Ile Gly His

(2S)-2-{2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

His Ile His Gly

2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]acetic acid

C20H30N8O5 (462.2339)


   

His Leu Gly His

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

His Leu His Gly

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

C20H30N8O5 (462.2339)


   

His Val Ala His

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

C20H30N8O5 (462.2339)


   

His Val His Ala

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

C20H30N8O5 (462.2339)


   

Ile Glu Thr Thr

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

C19H34N4O9 (462.2326)


   

Ile Gly His His

(2S)-2-[(2S)-2-{2-[(2S,3S)-2-amino-3-methylpentanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Ile His Gly His

(2S)-2-{2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Ile His His Gly

2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]acetic acid

C20H30N8O5 (462.2339)


   

Ile Thr Glu Thr

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

C19H34N4O9 (462.2326)


   

Ile Thr Thr Glu

(2S)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]pentanedioic acid

C19H34N4O9 (462.2326)


   

Lys Cys Gly Arg

(2S)-5-carbamimidamido-2-{2-[(2R)-2-[(2S)-2,6-diaminohexanamido]-3-sulfanylpropanamido]acetamido}pentanoic acid

C17H34N8O5S (462.2373)


   

Lys Cys Arg Gly

2-[(2S)-5-carbamimidamido-2-[(2R)-2-[(2S)-2,6-diaminohexanamido]-3-sulfanylpropanamido]pentanamido]acetic acid

C17H34N8O5S (462.2373)


   

Lys Gly Cys Arg

(2S)-5-carbamimidamido-2-[(2R)-2-{2-[(2S)-2,6-diaminohexanamido]acetamido}-3-sulfanylpropanamido]pentanoic acid

C17H34N8O5S (462.2373)


   

Lys Gly Arg Cys

(2R)-2-[(2S)-5-carbamimidamido-2-{2-[(2S)-2,6-diaminohexanamido]acetamido}pentanamido]-3-sulfanylpropanoic acid

C17H34N8O5S (462.2373)


   

Lys Asn Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S)-3-carbamoyl-2-[(2S)-2,6-diaminohexanamido]propanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Lys Gln Ser Thr

(2S,3R)-2-[(2S)-2-[(2S)-4-carbamoyl-2-[(2S)-2,6-diaminohexanamido]butanamido]-3-hydroxypropanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Lys Gln Thr Ser

(2S)-2-[(2S,3R)-2-[(2S)-4-carbamoyl-2-[(2S)-2,6-diaminohexanamido]butanamido]-3-hydroxybutanamido]-3-hydroxypropanoic acid

C18H34N6O8 (462.2438)


   

Lys Arg Cys Gly

2-[(2R)-2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]-3-sulfanylpropanamido]acetic acid

C17H34N8O5S (462.2373)


   

Lys Arg Gly Cys

(2R)-2-{2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]acetamido}-3-sulfanylpropanoic acid

C17H34N8O5S (462.2373)


   

Lys Ser Gln Thr

(2S,3R)-2-[(2S)-4-carbamoyl-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxypropanamido]butanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Lys Ser Thr Gln

(2S)-4-carbamoyl-2-[(2S,3R)-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]butanoic acid

C18H34N6O8 (462.2438)


   

Lys Thr Asn Thr

(2S,3R)-2-[(2S)-3-carbamoyl-2-[(2S,3R)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxybutanamido]propanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Lys Thr Gln Ser

(2S)-2-[(2S)-4-carbamoyl-2-[(2S,3R)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxybutanamido]butanamido]-3-hydroxypropanoic acid

C18H34N6O8 (462.2438)


   

Lys Thr Ser Gln

(2S)-4-carbamoyl-2-[(2S)-2-[(2S,3R)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]butanoic acid

C18H34N6O8 (462.2438)


   

Lys Thr Thr Asn

(2S)-3-carbamoyl-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]propanoic acid

C18H34N6O8 (462.2438)


   

Leu Glu Thr Thr

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

C19H34N4O9 (462.2326)


   

Leu Gly His His

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-4-methylpentanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Leu His Gly His

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C20H30N8O5 (462.2339)


   

Leu His His Gly

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

C20H30N8O5 (462.2339)


   

Leu Thr Glu Thr

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

C19H34N4O9 (462.2326)


   

Leu Thr Thr Glu

(2S)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2-amino-4-methylpentanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]pentanedioic acid

C19H34N4O9 (462.2326)


   

Asn Lys Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-carbamoylpropanamido]hexanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Asn Thr Lys Thr

(2S,3R)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]hexanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Asn Thr Thr Lys

(2S)-6-amino-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Gln Lys Ser Thr

(2S,3R)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-4-carbamoylbutanamido]hexanamido]-3-hydroxypropanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Gln Lys Thr Ser

(2S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-amino-4-carbamoylbutanamido]hexanamido]-3-hydroxybutanamido]-3-hydroxypropanoic acid

C18H34N6O8 (462.2438)


   

Gln Ser Lys Thr

(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]hexanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Gln Ser Thr Lys

(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-hydroxybutanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Gln Thr Lys Ser

(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxybutanamido]hexanamido]-3-hydroxypropanoic acid

C18H34N6O8 (462.2438)


   

Gln Thr Ser Lys

(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxybutanamido]-3-hydroxypropanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Arg Cys Gly Lys

(2S)-6-amino-2-{2-[(2R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]acetamido}hexanoic acid

C17H34N8O5S (462.2373)


   

Arg Cys Lys Gly

2-[(2S)-6-amino-2-[(2R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-sulfanylpropanamido]hexanamido]acetic acid

C17H34N8O5S (462.2373)


   

Arg Gly Cys Lys

(2S)-6-amino-2-[(2R)-2-{2-[(2S)-2-amino-5-carbamimidamidopentanamido]acetamido}-3-sulfanylpropanamido]hexanoic acid

C17H34N8O5S (462.2373)


   

Arg Gly Lys Cys

(2R)-2-[(2S)-6-amino-2-{2-[(2S)-2-amino-5-carbamimidamidopentanamido]acetamido}hexanamido]-3-sulfanylpropanoic acid

C17H34N8O5S (462.2373)


   

Arg Lys Cys Gly

2-[(2R)-2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]-3-sulfanylpropanamido]acetic acid

C17H34N8O5S (462.2373)


   

Arg Lys Gly Cys

(2R)-2-{2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]acetamido}-3-sulfanylpropanoic acid

C17H34N8O5S (462.2373)


   

Ser Lys Gln Thr

(2S,3R)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-hydroxypropanamido]hexanamido]-4-carbamoylbutanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Ser Lys Thr Gln

(2S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-hydroxypropanamido]hexanamido]-3-hydroxybutanamido]-4-carbamoylbutanoic acid

C18H34N6O8 (462.2438)


   

Ser Gln Lys Thr

(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]hexanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Ser Gln Thr Lys

(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-hydroxybutanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Ser Thr Lys Gln

(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxybutanamido]hexanamido]-4-carbamoylbutanoic acid

C18H34N6O8 (462.2438)


   

Ser Thr Gln Lys

(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-hydroxybutanamido]-4-carbamoylbutanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Thr Glu Ile Thr

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

C19H34N4O9 (462.2326)


   

Thr Glu Leu Thr

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

C19H34N4O9 (462.2326)


   

Thr Glu Thr Ile

(2S,3S)-2-[(2S,3R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-carboxybutanamido]-3-hydroxybutanamido]-3-methylpentanoic acid

C19H34N4O9 (462.2326)


   

Thr Glu Thr Leu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-carboxybutanamido]-3-hydroxybutanamido]-4-methylpentanoic acid

C19H34N4O9 (462.2326)


   

Thr Ile Glu Thr

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

C19H34N4O9 (462.2326)


   

Thr Ile Thr Glu

(2S)-2-[(2S,3R)-2-[(2S,3S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-methylpentanamido]-3-hydroxybutanamido]pentanedioic acid

C19H34N4O9 (462.2326)


   

Thr Lys Asn Thr

(2S,3R)-2-[(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-amino-3-hydroxybutanamido]hexanamido]-3-carbamoylpropanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Thr Lys Gln Ser

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-amino-3-hydroxybutanamido]hexanamido]-4-carbamoylbutanamido]-3-hydroxypropanoic acid

C18H34N6O8 (462.2438)


   

Thr Lys Ser Gln

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-amino-3-hydroxybutanamido]hexanamido]-3-hydroxypropanamido]-4-carbamoylbutanoic acid

C18H34N6O8 (462.2438)


   

Thr Lys Thr Asn

(2S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S,3R)-2-amino-3-hydroxybutanamido]hexanamido]-3-hydroxybutanamido]-3-carbamoylpropanoic acid

C18H34N6O8 (462.2438)


   

Thr Leu Glu Thr

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

C19H34N4O9 (462.2326)


   

Thr Leu Thr Glu

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-methylpentanamido]-3-hydroxybutanamido]pentanedioic acid

C19H34N4O9 (462.2326)


   

Thr Asn Lys Thr

(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]hexanamido]-3-hydroxybutanoic acid

C18H34N6O8 (462.2438)


   

Thr Asn Thr Lys

(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-hydroxybutanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Thr Gln Lys Ser

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-carbamoylbutanamido]hexanamido]-3-hydroxypropanoic acid

C18H34N6O8 (462.2438)


   

Thr Gln Ser Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-carbamoylbutanamido]-3-hydroxypropanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Thr Ser Lys Gln

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxypropanamido]hexanamido]-4-carbamoylbutanoic acid

C18H34N6O8 (462.2438)


   

Thr Ser Gln Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxypropanamido]-4-carbamoylbutanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Thr Thr Glu Ile

(2S,3S)-2-[(2S)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C19H34N4O9 (462.2326)


   

Thr Thr Glu Leu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C19H34N4O9 (462.2326)


   

Thr Thr Ile Glu

(2S)-2-[(2S,3S)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-3-methylpentanamido]pentanedioic acid

C19H34N4O9 (462.2326)


   

Thr Thr Lys Asn

(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]hexanamido]-3-carbamoylpropanoic acid

C18H34N6O8 (462.2438)


   

Thr Thr Leu Glu

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-4-methylpentanamido]pentanedioic acid

C19H34N4O9 (462.2326)


   

Thr Thr Asn Lys

(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-3-carbamoylpropanamido]hexanoic acid

C18H34N6O8 (462.2438)


   

Val Ala His His

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

C20H30N8O5 (462.2339)


   

Val His Ala His

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

C20H30N8O5 (462.2339)


   

Val His His Ala

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

C20H30N8O5 (462.2339)


   

Neryl rhamnosyl-glucoside

2-{[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C22H38O10 (462.2465)


   

xi-Linalool 3-[rhamnosyl-(1->6)-glucoside]

2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C22H38O10 (462.2465)


   

Vistusertib

Vistusertib

C25H30N6O3 (462.2379)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2201 - mTOR Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor Vistusertib (AZD2014) is an ATP competitive mTOR inhibitor with an IC50 of 2.81 nM. AZD2014 inhibits both mTORC1 and mTORC2 complexes. Vistusertib (AZD2014) is an ATP competitive mTOR inhibitor with an IC50 of 2.81 nM. AZD2014 inhibits both mTORC1 and mTORC2 complexes.

   
   

Titanium bis(triethanolamine)diisopropoxide

Titanium bis(triethanolamine)diisopropoxide

C18H42N2O8Ti (462.242)


   

5-O-Allyl-2,3,4-tri-O-benzyl-D-ribitol

5-O-Allyl-2,3,4-tri-O-benzyl-D-ribitol

C29H34O5 (462.2406)


   
   

Unii-4T71DC0G0A

Unii-4T71DC0G0A

C26H30N4O4 (462.2267)


   

Tixocortol pivalate

Tixocortol pivalate

C26H38O5S (462.244)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones D018926 - Anti-Allergic Agents

   
   

Amelometasone

Amelometasone

C26H35FO6 (462.2418)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid

   

5-[3-(3,5-Dimethyl-1,2,4-triazol-1-yl)-2-hydroxypropoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester

5-[3-(3,5-Dimethyl-1,2,4-triazol-1-yl)-2-hydroxypropoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester

C26H30N4O4 (462.2267)


   

(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate

(4Z,7Z,9E,11E,13R,14S,16Z,19Z)-13-{[(2R)-2-azaniumyl-2-carboxylatoethyl]sulfanyl}-14-hydroxydocosa-4,7,9,11,16,19-hexaenoate

C25H36NO5S- (462.2314)


   

Arg-Lys-Cys-Gly

Arg-Lys-Cys-Gly

C17H34N8O5S (462.2373)


A tetrapeptide composed of L-arginine, L-lysine, L-cysteine, and glycine joined in sequence by peptide linkages.

   

(1S,9R,10R,11R)-5-(cyclopenten-1-yl)-10-(hydroxymethyl)-11-N,11-N-dimethyl-6-oxo-12-N-phenyl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11,12-dicarboxamide

(1S,9R,10R,11R)-5-(cyclopenten-1-yl)-10-(hydroxymethyl)-11-N,11-N-dimethyl-6-oxo-12-N-phenyl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11,12-dicarboxamide

C26H30N4O4 (462.2267)


   

(1R,9S,10S,11S)-5-(cyclopenten-1-yl)-10-(hydroxymethyl)-11-N,11-N-dimethyl-6-oxo-12-N-phenyl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11,12-dicarboxamide

(1R,9S,10S,11S)-5-(cyclopenten-1-yl)-10-(hydroxymethyl)-11-N,11-N-dimethyl-6-oxo-12-N-phenyl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11,12-dicarboxamide

C26H30N4O4 (462.2267)


   

1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea

1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea

C26H30N4O4 (462.2267)


   

(1S)-2-benzoyl-1-(hydroxymethyl)-7-methoxy-N-propyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

(1S)-2-benzoyl-1-(hydroxymethyl)-7-methoxy-N-propyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide

C26H30N4O4 (462.2267)


   

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

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

C26H30N4O4 (462.2267)


   

p-Mentha-1-ene-8-yl 6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside

p-Mentha-1-ene-8-yl 6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside

C22H38O10 (462.2465)


   

2,3-dihydroxypropyl [3-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-2-hydroxypropyl] hydrogen phosphate

2,3-dihydroxypropyl [3-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-2-hydroxypropyl] hydrogen phosphate

C22H39O8P (462.2382)


   

(1-phosphonooxy-3-propanoyloxypropan-2-yl) (9Z,12Z)-hexadeca-9,12-dienoate

(1-phosphonooxy-3-propanoyloxypropan-2-yl) (9Z,12Z)-hexadeca-9,12-dienoate

C22H39O8P (462.2382)


   

(1-acetyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-heptadeca-9,12-dienoate

(1-acetyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-heptadeca-9,12-dienoate

C22H39O8P (462.2382)


   

(13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(1-)

(13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoate(1-)

C25H36NO5S (462.2314)


A docosanoid anion obtained by deprotonation of the two carboxy groups and protonation of the glutamyl alpha-amino group of (13R)-S-cysteinylglycinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid; major species at pH 7.3.

   
   
   
   
   
   

ST 26:4;O2;S

ST 26:4;O2;S

C26H38O5S (462.244)


   

AGI-5198

AGI-5198

C27H31FN4O2 (462.2431)


AGI-5198 (IDH-C35) is a potent and selective mutant IDH1R132H inhibitor with an IC50 of 0.07 μM.

   

(2s,3r,4r,5r,6s)-2-{[(2r,3r,4s,5r,6r)-2-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol

(2s,3r,4r,5r,6s)-2-{[(2r,3r,4s,5r,6r)-2-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

2-[7-hydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-5-yl]-7-(3-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

2-[7-hydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-5-yl]-7-(3-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

2-[3,5-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-7-[(2r)-3-methylbut-3-en-2-yl]-1-benzofuran-4,6-diol

2-[3,5-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-7-[(2r)-3-methylbut-3-en-2-yl]-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

4-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-1,7-dihydroxy-3-methoxy-2-(3-methylbut-2-en-1-yl)xanthen-9-one

4-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-1,7-dihydroxy-3-methoxy-2-(3-methylbut-2-en-1-yl)xanthen-9-one

C29H34O5 (462.2406)


   

7-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2-[(2r)-6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-4-yl]-1-benzofuran-6-ol

7-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2-[(2r)-6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-4-yl]-1-benzofuran-6-ol

C29H34O5 (462.2406)


   

(2r,3r,4s,5s,6r)-2-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C22H38O10 (462.2465)


   

4-(3,7-dimethylocta-2,6-dien-1-yl)-1,7-dihydroxy-3-methoxy-2-(3-methylbut-2-en-1-yl)xanthen-9-one

4-(3,7-dimethylocta-2,6-dien-1-yl)-1,7-dihydroxy-3-methoxy-2-(3-methylbut-2-en-1-yl)xanthen-9-one

C29H34O5 (462.2406)


   

(2s,3as,6r,7as)-1-[(2r,3s)-2-{[(2s)-1,2-dihydroxy-3-(4-hydroxyphenyl)propylidene]amino}-3-methylpentanoyl]-6-hydroxy-octahydroindole-2-carboxylic acid

(2s,3as,6r,7as)-1-[(2r,3s)-2-{[(2s)-1,2-dihydroxy-3-(4-hydroxyphenyl)propylidene]amino}-3-methylpentanoyl]-6-hydroxy-octahydroindole-2-carboxylic acid

C24H34N2O7 (462.2366)


   

2-[3,5-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-7-(3-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

2-[3,5-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-7-(3-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

2-({2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}oxy)-6-methyloxane-3,4,5-triol

2-({2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}oxy)-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

1,15-bis(2h-1,3-benzodioxol-5-yl)pentadeca-1,14-dien-8-one

1,15-bis(2h-1,3-benzodioxol-5-yl)pentadeca-1,14-dien-8-one

C29H34O5 (462.2406)


   

7-(3,7-dimethylocta-2,6-dien-1-yl)-2-[(2r)-6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-4-yl]-1-benzofuran-6-ol

7-(3,7-dimethylocta-2,6-dien-1-yl)-2-[(2r)-6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-4-yl]-1-benzofuran-6-ol

C29H34O5 (462.2406)


   

(2r,3s)-7-(6-hydroxy-1-benzofuran-2-yl)-2-methyl-6-(3-methylbut-2-en-1-yl)-2-(4-methylpent-3-en-1-yl)-3,4-dihydro-1-benzopyran-3,5-diol

(2r,3s)-7-(6-hydroxy-1-benzofuran-2-yl)-2-methyl-6-(3-methylbut-2-en-1-yl)-2-(4-methylpent-3-en-1-yl)-3,4-dihydro-1-benzopyran-3,5-diol

C29H34O5 (462.2406)


   

7-(6-hydroxy-1-benzofuran-2-yl)-2-methyl-6-(3-methylbut-2-en-1-yl)-2-(4-methylpent-3-en-1-yl)-3,4-dihydro-1-benzopyran-3,5-diol

7-(6-hydroxy-1-benzofuran-2-yl)-2-methyl-6-(3-methylbut-2-en-1-yl)-2-(4-methylpent-3-en-1-yl)-3,4-dihydro-1-benzopyran-3,5-diol

C29H34O5 (462.2406)


   

(2s,3as,6r,7as)-1-[(2r)-2-{[(2s)-1,2-dihydroxy-3-(4-hydroxyphenyl)propylidene]amino}-4-methylpentanoyl]-6-hydroxy-octahydroindole-2-carboxylic acid

(2s,3as,6r,7as)-1-[(2r)-2-{[(2s)-1,2-dihydroxy-3-(4-hydroxyphenyl)propylidene]amino}-4-methylpentanoyl]-6-hydroxy-octahydroindole-2-carboxylic acid

C24H34N2O7 (462.2366)


   

(2r,3r,4r,5r,6s)-2-{[(2r,3s,4s,5r,6r)-6-{[(1r,2r,4s)-3,3-dimethylbicyclo[2.2.1]heptan-2-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol

(2r,3r,4r,5r,6s)-2-{[(2r,3s,4s,5r,6r)-6-{[(1r,2r,4s)-3,3-dimethylbicyclo[2.2.1]heptan-2-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

(1e,14e)-1,15-bis(2h-1,3-benzodioxol-5-yl)pentadeca-1,14-dien-8-one

(1e,14e)-1,15-bis(2h-1,3-benzodioxol-5-yl)pentadeca-1,14-dien-8-one

C29H34O5 (462.2406)


   

2-[(3,7-dimethylocta-2,6-dien-1-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

2-[(3,7-dimethylocta-2,6-dien-1-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C22H38O10 (462.2465)


   

2-[3,5-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-7-(2-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

2-[3,5-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-7-(2-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

7-(3,7-dimethylocta-2,6-dien-1-yl)-2-[6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-4-yl]-1-benzofuran-6-ol

7-(3,7-dimethylocta-2,6-dien-1-yl)-2-[6-hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-4-yl]-1-benzofuran-6-ol

C29H34O5 (462.2406)


   

2-[7-hydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-5-yl]-7-[(2r)-3-methylbut-3-en-2-yl]-1-benzofuran-4,6-diol

2-[7-hydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-5-yl]-7-[(2r)-3-methylbut-3-en-2-yl]-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

(2s,3r,4s,5s,6r)-2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6r)-2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C22H38O10 (462.2465)


   

5,8-dihydroxy-2,2-dimethyl-12-(3,7,7-trimethyloct-2-en-1-yl)-1,11-dioxatetracen-6-one

5,8-dihydroxy-2,2-dimethyl-12-(3,7,7-trimethyloct-2-en-1-yl)-1,11-dioxatetracen-6-one

C29H34O5 (462.2406)


   

7-(3-methylbut-3-en-2-yl)-2-{5,5,13,13-tetramethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-9-yl}-1-benzofuran-4,6-diol

7-(3-methylbut-3-en-2-yl)-2-{5,5,13,13-tetramethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-9-yl}-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

2-[(2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

2-[(2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

7-[(2r)-3-methylbut-3-en-2-yl]-2-{5,5,13,13-tetramethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-9-yl}-1-benzofuran-4,6-diol

7-[(2r)-3-methylbut-3-en-2-yl]-2-{5,5,13,13-tetramethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-9-yl}-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s,6r)-2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

2-{[6-({3,3-dimethylbicyclo[2.2.1]heptan-2-yl}methoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol

2-{[6-({3,3-dimethylbicyclo[2.2.1]heptan-2-yl}methoxy)-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol

C22H38O10 (462.2465)


   

2-[7-hydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-5-yl]-7-(2-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

2-[7-hydroxy-2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-1-benzopyran-5-yl]-7-(2-methylbut-3-en-2-yl)-1-benzofuran-4,6-diol

C29H34O5 (462.2406)


   

5,8-dihydroxy-2,2-dimethyl-12-[(2e)-3,7,7-trimethyloct-2-en-1-yl]-1,11-dioxatetracen-6-one

5,8-dihydroxy-2,2-dimethyl-12-[(2e)-3,7,7-trimethyloct-2-en-1-yl]-1,11-dioxatetracen-6-one

C29H34O5 (462.2406)


   

(2r,3r,4s,5s,6r)-2-{[(2z)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-{[(2z)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C22H38O10 (462.2465)