Exact Mass: 541.3767

Exact Mass Matches: 541.3767

Found 113 metabolites which its exact mass value is equals to given mass value 541.3767, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

CDDO-Im

(4aR,6aR,6aS,6bR,8aS,12aS,14bS)-8a-(imidazole-1-carbonyl)-4,4,6a,6b,11,11,14b-heptamethyl-3,13-dioxo-4a,5,6,6a,7,8,9,10,12,12a-decahydropicene-2-carbonitrile

C34H43N3O3 (541.3304)


   

Poststatin

2-[2-(3-amino-2-oxopentanamido)-N-(2,6-diamino-3,7-dimethyl-5-oxooctanoyl)-4-methylpentanamido]-3-methylbutanoic acid

C26H47N5O7 (541.3475)


   
   

Acutifolin palmitate

Acutifolin palmitate

C33H51NO5 (541.3767)


   

(2S,2S)-5-(2,3-Epoxy-3-methylbutyl)-3-(3-hydroxy-3-methyl-1-palmitoyloxybut-2-yl)indole

(2S,2S)-5-(2,3-Epoxy-3-methylbutyl)-3-(3-hydroxy-3-methyl-1-palmitoyloxybut-2-yl)indole

C34H55NO4 (541.4131)


   

Pro Lys Val Lys Ala

Pro Lys Val Lys Ala

C25H47N7O6 (541.3588)


   

Leu Leu Val Val Ala

Leu Leu Val Val Ala

C27H51N5O6 (541.3839)


   

Ile Leu Ala Ile Val

Ile Leu Ala Ile Val

C27H51N5O6 (541.3839)


   

Leu Leu Leu Ala Ala

Leu Leu Leu Ala Ala

C27H51N5O6 (541.3839)


   

13-dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

NCGC00381435-01!13-dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

C28H51N3O7 (541.3727)


   

13-dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone [IIN-based on: CCMSLIB00000848775]

NCGC00381435-01!13-dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone [IIN-based on: CCMSLIB00000848775]

C28H51N3O7 (541.3727)


   

13-dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone [IIN-based: Match]

NCGC00381435-01!13-dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone [IIN-based: Match]

C28H51N3O7 (541.3727)


   

PKVKA

Pro Lys Val Lys Ala

C25H47N7O6 (541.3588)


   

VLLVV

Val Leu Leu Val Val

C27H51N5O6 (541.3839)


   

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-27-oyl taurine

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-27-oyl taurine

C29H51NO6S (541.3437)


   

13-(2-Dodecanyl)-6-(1-hydroxyethyl)-3-(hydroxymethyl)-9-isopropyl-12-methyl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

13-(2-Dodecanyl)-6-(1-hydroxyethyl)-3-(hydroxymethyl)-9-isopropyl-12-methyl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

C28H51N3O7 (541.3727)


   

LPS O-19:0;O

1-(2-methoxy-octadecanyl)-sn-glycero-3-phosphoserine

C25H52NO9P (541.338)


   

ST 27:1;O4;T

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-27-oyl taurine

C29H51NO6S (541.3437)


   
   

Pentakis(diethylamino)tantalum

Pentakis(diethylamino)tantalum

C20H50N5Ta (541.3546)


   

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl taurine

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl taurine

C29H51NO6S (541.3437)


A cholestanoid obtained by formal condensation of the carboxy group of (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid with the amino group of taurine.

   

2-[[2-[(3-Amino-2-oxopentanoyl)amino]-4-methylpentanoyl]-(2,6-diamino-3,7-dimethyl-5-oxooctanoyl)amino]-3-methylbutanoic acid

2-[[2-[(3-Amino-2-oxopentanoyl)amino]-4-methylpentanoyl]-(2,6-diamino-3,7-dimethyl-5-oxooctanoyl)amino]-3-methylbutanoic acid

C26H47N5O7 (541.3475)


   

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-(4-methyl-1-piperazinyl)benzamide

C28H43N7O4 (541.3376)


   

1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

1-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-1-methyl-3-[4-(1-piperidinyl)phenyl]urea

C28H43N7O4 (541.3376)


   

13-Dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

13-Dodecan-2-yl-6-(1-hydroxyethyl)-3-(hydroxymethyl)-12-methyl-9-propan-2-yl-1-oxa-4,7,10-triazacyclotridecane-2,5,8,11-tetrone

C28H51N3O7 (541.3727)


   

2-[[(2R,6R)-6-[(3R,5S,7R,10S,13R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoyl]amino]ethanesulonic acid

2-[[(2R,6R)-6-[(3R,5S,7R,10S,13R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptanoyl]amino]ethanesulonic acid

C29H51NO6S (541.3437)


   
   

HexCer 20:3;2O/3:0

HexCer 20:3;2O/3:0

C29H51NO8 (541.3614)


   

HexCer 15:3;2O/8:0

HexCer 15:3;2O/8:0

C29H51NO8 (541.3614)


   

HexCer 17:3;2O/6:0

HexCer 17:3;2O/6:0

C29H51NO8 (541.3614)


   

HexCer 14:3;2O/9:0

HexCer 14:3;2O/9:0

C29H51NO8 (541.3614)


   

HexCer 21:3;2O/2:0

HexCer 21:3;2O/2:0

C29H51NO8 (541.3614)


   

HexCer 16:3;2O/7:0

HexCer 16:3;2O/7:0

C29H51NO8 (541.3614)


   

HexCer 19:3;2O/4:0

HexCer 19:3;2O/4:0

C29H51NO8 (541.3614)


   

HexCer 18:3;2O/5:0

HexCer 18:3;2O/5:0

C29H51NO8 (541.3614)


   

NAGly 18:5/13:1

NAGly 18:5/13:1

C33H51NO5 (541.3767)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxydodec-5-enoyl]amino]heptadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxydodec-5-enoyl]amino]heptadeca-4,8,12-triene-1-sulfonic acid

C29H51NO6S (541.3437)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxytetradec-9-enoyl]amino]pentadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxytetradec-9-enoyl]amino]pentadeca-4,8,12-triene-1-sulfonic acid

C29H51NO6S (541.3437)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxypentadec-9-enoyl]amino]tetradeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxypentadec-9-enoyl]amino]tetradeca-4,8,12-triene-1-sulfonic acid

C29H51NO6S (541.3437)


   

(4E,8E)-3-hydroxy-2-[[(4Z,7Z)-2-hydroxyhexadeca-4,7-dienoyl]amino]trideca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(4Z,7Z)-2-hydroxyhexadeca-4,7-dienoyl]amino]trideca-4,8-diene-1-sulfonic acid

C29H51NO6S (541.3437)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxytridec-8-enoyl]amino]hexadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-2-hydroxytridec-8-enoyl]amino]hexadeca-4,8,12-triene-1-sulfonic acid

C29H51NO6S (541.3437)


   

2-[[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]amino]-3-hydroxytetradecane-1-sulfonic acid

2-[[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]amino]-3-hydroxytetradecane-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E)-2-[[(Z)-heptadec-9-enoyl]amino]-3-hydroxytrideca-4,8-diene-1-sulfonic acid

(4E,8E)-2-[[(Z)-heptadec-9-enoyl]amino]-3-hydroxytrideca-4,8-diene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-2-(hexadecanoylamino)-3-hydroxytetradeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-2-(hexadecanoylamino)-3-hydroxytetradeca-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E)-2-[[(Z)-hexadec-9-enoyl]amino]-3-hydroxytetradeca-4,8-diene-1-sulfonic acid

(4E,8E)-2-[[(Z)-hexadec-9-enoyl]amino]-3-hydroxytetradeca-4,8-diene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-2-(decanoylamino)-3-hydroxyicosa-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-2-(decanoylamino)-3-hydroxyicosa-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(E)-2-[[(9Z,12Z)-heptadeca-9,12-dienoyl]amino]-3-hydroxytridec-4-ene-1-sulfonic acid

(E)-2-[[(9Z,12Z)-heptadeca-9,12-dienoyl]amino]-3-hydroxytridec-4-ene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(E)-3-hydroxy-2-[[(9Z,12Z)-nonadeca-9,12-dienoyl]amino]undec-4-ene-1-sulfonic acid

(E)-3-hydroxy-2-[[(9Z,12Z)-nonadeca-9,12-dienoyl]amino]undec-4-ene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-3-hydroxy-2-(pentadecanoylamino)pentadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-(pentadecanoylamino)pentadeca-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

3-hydroxy-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]dodecane-1-sulfonic acid

3-hydroxy-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]dodecane-1-sulfonic acid

C30H55NO5S (541.3801)


   

(E)-3-hydroxy-2-[[(11Z,14Z)-icosa-11,14-dienoyl]amino]dec-4-ene-1-sulfonic acid

(E)-3-hydroxy-2-[[(11Z,14Z)-icosa-11,14-dienoyl]amino]dec-4-ene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(E)-3-hydroxy-2-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]dodec-4-ene-1-sulfonic acid

(E)-3-hydroxy-2-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]dodec-4-ene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E)-3-hydroxy-2-[[(Z)-tridec-9-enoyl]amino]heptadeca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(Z)-tridec-9-enoyl]amino]heptadeca-4,8-diene-1-sulfonic acid

C30H55NO5S (541.3801)


   

3-hydroxy-2-[[(11Z,14Z,17Z)-icosa-11,14,17-trienoyl]amino]decane-1-sulfonic acid

3-hydroxy-2-[[(11Z,14Z,17Z)-icosa-11,14,17-trienoyl]amino]decane-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-2-(dodecanoylamino)-3-hydroxyoctadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-2-(dodecanoylamino)-3-hydroxyoctadeca-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-3-hydroxy-2-(tetradecanoylamino)hexadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-(tetradecanoylamino)hexadeca-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E)-3-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]dodeca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]dodeca-4,8-diene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E)-3-hydroxy-2-[[(Z)-tetradec-9-enoyl]amino]hexadeca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(Z)-tetradec-9-enoyl]amino]hexadeca-4,8-diene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-3-hydroxy-2-(undecanoylamino)nonadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-(undecanoylamino)nonadeca-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(E)-2-[[(9Z,12Z)-hexadeca-9,12-dienoyl]amino]-3-hydroxytetradec-4-ene-1-sulfonic acid

(E)-2-[[(9Z,12Z)-hexadeca-9,12-dienoyl]amino]-3-hydroxytetradec-4-ene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E,12E)-3-hydroxy-2-(tridecanoylamino)heptadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-(tridecanoylamino)heptadeca-4,8,12-triene-1-sulfonic acid

C30H55NO5S (541.3801)


   

(4E,8E)-3-hydroxy-2-[[(Z)-pentadec-9-enoyl]amino]pentadeca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(Z)-pentadec-9-enoyl]amino]pentadeca-4,8-diene-1-sulfonic acid

C30H55NO5S (541.3801)


   

4-[3-acetyloxy-2-[(Z)-octadec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[3-acetyloxy-2-[(Z)-octadec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[3-heptanoyloxy-2-[(Z)-tridec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[3-heptanoyloxy-2-[(Z)-tridec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[2-[(Z)-pentadec-9-enoyl]oxy-3-pentanoyloxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[2-[(Z)-pentadec-9-enoyl]oxy-3-pentanoyloxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[3-hexanoyloxy-2-[(Z)-tetradec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[3-hexanoyloxy-2-[(Z)-tetradec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[3-butanoyloxy-2-[(Z)-hexadec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[3-butanoyloxy-2-[(Z)-hexadec-9-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[2-[(Z)-heptadec-9-enoyl]oxy-3-propanoyloxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[2-[(Z)-heptadec-9-enoyl]oxy-3-propanoyloxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[2-decanoyloxy-3-[(E)-dec-4-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[2-decanoyloxy-3-[(E)-dec-4-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   

4-[3-decanoyloxy-2-[(E)-dec-4-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

4-[3-decanoyloxy-2-[(E)-dec-4-enoyl]oxypropoxy]-2-(trimethylazaniumyl)butanoate

C30H55NO7 (541.3978)


   
   
   
   

ST 27:0;O6;Gly

ST 27:0;O6;Gly

C29H51NO8 (541.3614)


   

ST 24:4;O;HexNAc

ST 24:4;O;HexNAc

C32H47NO6 (541.3403)


   
   
   

CDDO-Im

CDDO-Im

C34H43N3O3 (541.3304)


CDDO-Im (RTA-403) is an activator of Nrf2 and PPAR, with Kis of 232 and 344 nM for PPARα and PPARγ[1][2].

   

(2s)-2-(5-{[(2s)-3,3-dimethyloxiran-2-yl]methyl}-1h-indol-3-yl)-3-hydroxy-3-methylbutyl hexadecanoate

(2s)-2-(5-{[(2s)-3,3-dimethyloxiran-2-yl]methyl}-1h-indol-3-yl)-3-hydroxy-3-methylbutyl hexadecanoate

C34H55NO4 (541.4131)


   

(2s)-1-(4,8-dimethoxy-1-methyl-2-oxoquinolin-3-yl)-3-methylbut-3-en-2-yl hexadecanoate

(2s)-1-(4,8-dimethoxy-1-methyl-2-oxoquinolin-3-yl)-3-methylbut-3-en-2-yl hexadecanoate

C33H51NO5 (541.3767)


   

1-(4,8-dimethoxy-1-methyl-2-oxoquinolin-3-yl)-3-methylbut-3-en-2-yl hexadecanoate

1-(4,8-dimethoxy-1-methyl-2-oxoquinolin-3-yl)-3-methylbut-3-en-2-yl hexadecanoate

C33H51NO5 (541.3767)


   

2-{5-[(3,3-dimethyloxiran-2-yl)methyl]-1h-indol-3-yl}-3-hydroxy-3-methylbutyl hexadecanoate

2-{5-[(3,3-dimethyloxiran-2-yl)methyl]-1h-indol-3-yl}-3-hydroxy-3-methylbutyl hexadecanoate

C34H55NO4 (541.4131)


   

(2s)-2-[(2r)-2-[(3s)-3-amino-2-oxopentanamido]-n-[(2s,6s)-2,6-diamino-3,7-dimethyl-5-oxooctanoyl]-4-methylpentanamido]-3-methylbutanoic acid

(2s)-2-[(2r)-2-[(3s)-3-amino-2-oxopentanamido]-n-[(2s,6s)-2,6-diamino-3,7-dimethyl-5-oxooctanoyl]-4-methylpentanamido]-3-methylbutanoic acid

C26H47N5O7 (541.3475)