Exact Mass: 513.2012

Exact Mass Matches: 513.2012

Found 129 metabolites which its exact mass value is equals to given mass value 513.2012, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Feudomycin A

(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-9-ethyl-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione

C27H31NO9 (513.1999)


An aminoglycoside antibiotic that is (1S,3S)-3-ethyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracene having a 3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl residue attached at position 1 via a glycosidic linkage.

   

Validamycin B

(1R,2R,3S,4S,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl beta-D-glucopyranoside

C20H35NO14 (513.2057)


Active against rice sheath blight disease and Pellicularia sasakii. Active against rice sheath blight disease and Pellicularia sasakii

   

trans-Zeatin-O-glucoside riboside

2-{[(2E)-4-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C21H31N5O10 (513.2071)


Cytokinin, widely distributed in plants.Zeatin is a plant hormone derived from the purine adenine. It is a member of the plant growth hormone family known as cytokinins. Zeatin was first discovered in immature corn kernels from the genus Zea. Zeatin and derivatives were discovered to be the primary active ingredient in coconut milk, which has long been known to actively induce plant growth. ; As in the case of kinetin, zeatin has also been reported to have several in vitro anti-aging effects on human skin fibroblasts.(Wikipedia). Cytokinin, widely distributed in plants [DFC]

   

Bopta

5,8,11-tris(carboxymethyl)-1-phenyl-2-oxa-5,8,11-triazatridecane-4,13-dioic acid

C22H31N3O11 (513.1958)


   

Encaleret

2-[1-(3-{[1-(4-chloro-3-fluorophenyl)-2-methylpropan-2-yl]amino}-2-hydroxypropoxy)ethyl]-3-methyl-[1,1-biphenyl]-4-carboxylic acid

C29H33ClFNO4 (513.2082)


   

SCHEMBL14408667

SCHEMBL14408667

C20H35NO14 (513.2057)


   

Stephalonine I

Stephalonine I

C27H31NO9 (513.1999)


   
   

Daunomycin-11-Deoxy, 13-alcohol|Daunomycin-11-Deoxy, 13-alcohol; B,HCl

Daunomycin-11-Deoxy, 13-alcohol|Daunomycin-11-Deoxy, 13-alcohol; B,HCl

C27H31NO9 (513.1999)


   

11-Deoxydaunomycinol

11-Deoxydaunomycinol

C27H31NO9 (513.1999)


   

3alpha-(3,4,5-trimethoxycinnamoyloxy)tropan-6beta-benzoyloxy-7-beta-acetoxytropane

3alpha-(3,4,5-trimethoxycinnamoyloxy)tropan-6beta-benzoyloxy-7-beta-acetoxytropane

C27H31NO9 (513.1999)


   

Trans-Zeatin-riboside-O-glucoside

Trans-Zeatin-riboside-O-glucoside

C21H31N5O10 (513.2071)


Acquisition and generation of the data is financially supported by the Max-Planck-Society

   

Cis-Zeatin-riboside-O-glucoside

Cis-Zeatin-riboside-O-glucoside

C21H31N5O10 (513.2071)


Acquisition and generation of the data is financially supported by the Max-Planck-Society

   

Trans-Zeatin-riboside-o-glucoside-[d5]

Trans-Zeatin-riboside-o-glucoside-[d5]

C21H31N5O10 (513.2071)


Acquisition and generation of the data is financially supported by the Max-Planck-Society

   

trans-Zeatin riboside-O-glucoside

trans-Zeatin riboside-O-glucoside

C21H31N5O10 (513.2071)


   

Asp Gly His Trp

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

C23H27N7O7 (513.1972)


   

Asp Gly Trp His

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

C23H27N7O7 (513.1972)


   

Asp His Gly Trp

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

C23H27N7O7 (513.1972)


   

Asp His Trp Gly

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

C23H27N7O7 (513.1972)


   

Asp Trp Gly His

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

C23H27N7O7 (513.1972)


   

Asp Trp His Gly

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

C23H27N7O7 (513.1972)


   

Gly Asp His Trp

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

C23H27N7O7 (513.1972)


   

Gly Asp Trp His

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

C23H27N7O7 (513.1972)


   

Gly His Asp Trp

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

C23H27N7O7 (513.1972)


   

Gly His Trp Asp

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

C23H27N7O7 (513.1972)


   

Gly Trp Asp His

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

C23H27N7O7 (513.1972)


   

Gly Trp His Asp

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

C23H27N7O7 (513.1972)


   

His Asp Gly Trp

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

C23H27N7O7 (513.1972)


   

His Asp Trp Gly

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

C23H27N7O7 (513.1972)


   

His Gly Asp Trp

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

C23H27N7O7 (513.1972)


   

His Gly Trp Asp

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

C23H27N7O7 (513.1972)


   

His Trp Asp Gly

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

C23H27N7O7 (513.1972)


   

His Trp Gly Asp

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

C23H27N7O7 (513.1972)


   

Trp Asp Gly His

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

C23H27N7O7 (513.1972)


   

Trp Asp His Gly

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

C23H27N7O7 (513.1972)


   

Trp Gly Asp His

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

C23H27N7O7 (513.1972)


   

Trp Gly His Asp

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

C23H27N7O7 (513.1972)


   

Trp His Asp Gly

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

C23H27N7O7 (513.1972)


   

Trp His Gly Asp

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

C23H27N7O7 (513.1972)


   

Desmethylgliquidone

Desmethylgliquidone

C26H31N3O6S (513.1933)


   

trans-Zeatin-O-glucoside riboside

2-{[(2E)-4-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C21H31N5O10 (513.2071)


   

Validamycin B

(1R,2R,3S,4S,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl beta-D-glucopyranoside

C20H35NO14 (513.2057)


A member of the class of validamycins that is validamycin A in which the pro-R hydrogen at the unsubstituted position of the cycloxexane ring has been replaced by a hydroxy group.

   

Mal-amido-PEG4-NHS ester

Mal-amido-PEG4-NHS ester

C22H31N3O11 (513.1958)


   

Avoralstat

Avoralstat

C28H27N5O5 (513.2012)


C471 - Enzyme Inhibitor

   

5-[(2R)-2-Aminopropyl]-1-[3-(benzoyloxy)propyl]-2,3-dihydro-1H-indole-7-carbonitrile (2R,3R)-2,3-dihydroxybutanedioate

5-[(2R)-2-Aminopropyl]-1-[3-(benzoyloxy)propyl]-2,3-dihydro-1H-indole-7-carbonitrile (2R,3R)-2,3-dihydroxybutanedioate

C26H31N3O8 (513.2111)


   

Encaleret

4-[2-[1-[3-[[1-(4-Chloro-3-fluorophenyl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]ethyl]phenyl]-2-methylbenzoic acid

C29H33ClFNO4 (513.2082)


C78281 - Agent Affecting Musculoskeletal System

   

Gadobenate dimeglumine

Gadobenate dimeglumine

C22H31N3O11 (513.1958)


   

2-(4-methyl-1,4-diazepan-1-yl)-N-((5-methylpyrazin-2-yl)methyl)-5-oxo-5H-benzo[4,5]thiazolo[3,2-a][1,8]naphthyridine-6-carboxamide

2-(4-methyl-1,4-diazepan-1-yl)-N-((5-methylpyrazin-2-yl)methyl)-5-oxo-5H-benzo[4,5]thiazolo[3,2-a][1,8]naphthyridine-6-carboxamide

C27H27N7O2S (513.1947)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C25995 - RNA Polymerase Inhibitor

   

(2R,3R,4S,5S,6R)-2-(((E)-4-((9-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-yl)amino)-2-methylbut-2-en-1-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

(2R,3R,4S,5S,6R)-2-(((E)-4-((9-((2R,3R,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-6-yl)amino)-2-methylbut-2-en-1-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol

C21H31N5O10 (513.2071)


   

alpha-L-colitosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-D-glucosamine

alpha-L-colitosyl-(1->2)-beta-D-galactosyl-(1->3)-N-acetyl-D-glucosamine

C20H35NO14 (513.2057)


   

Gal(b1-3)[Fuc(a1-4)]b-QuiNAc

Gal(b1-3)[Fuc(a1-4)]b-QuiNAc

C20H35NO14 (513.2057)


   

GAS CWPS Trisaccharide

GAS CWPS Trisaccharide

C20H35NO14 (513.2057)


   

2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranose

2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranose

C20H35NO14 (513.2057)


   

6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranose

6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranose

C20H35NO14 (513.2057)


   

alpha-L-rhamnosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-L-rhamnose

alpha-L-rhamnosyl-(1->3)-N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-L-rhamnose

C20H35NO14 (513.2057)


   

6-deoxy-alpha-L-galactopyranosyl-(1->2)-6-deoxy-alpha-L-galactopyranosyl-(1->3)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose

6-deoxy-alpha-L-galactopyranosyl-(1->2)-6-deoxy-alpha-L-galactopyranosyl-(1->3)-2-(acetylamino)-2-deoxy-beta-D-glucopyranose

C20H35NO14 (513.2057)


   

(2S)-2-[(4S,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2S)-2-[(4S,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

[(1R)-2-(cyclopropylmethyl)-1-(3-fluorophenyl)sulfonyl-7-methoxy-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol

[(1R)-2-(cyclopropylmethyl)-1-(3-fluorophenyl)sulfonyl-7-methoxy-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol

C27H32FN3O4S (513.2097)


   

(2S)-2-[(4R,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2S)-2-[(4R,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

(2R)-2-[(4S,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2R)-2-[(4S,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

(2S)-2-[(4S,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2S)-2-[(4S,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

(2R)-2-[(4R,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2R)-2-[(4R,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

N-[(2S,4aR,12aS)-5-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-1,3-thiazole-4-carboxamide

N-[(2S,4aR,12aS)-5-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-1,3-thiazole-4-carboxamide

C25H31N5O5S (513.2046)


   

(2S)-2-[(4R,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2S)-2-[(4R,5R)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

(2R)-2-[(4R,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2R)-2-[(4R,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

(2R)-2-[(4S,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

(2R)-2-[(4S,5S)-8-(2-fluorophenyl)-4-methyl-5-[[methyl(3-pyridinylmethyl)amino]methyl]-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol

C27H32FN3O4S (513.2097)


   

N-[(2S,4aR,12aR)-5-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-1,3-thiazole-4-carboxamide

N-[(2S,4aR,12aR)-5-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-1,3-thiazole-4-carboxamide

C25H31N5O5S (513.2046)


   

N-[(2R,4aR,12aS)-5-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-1,3-thiazole-4-carboxamide

N-[(2R,4aR,12aS)-5-methyl-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-1,3-thiazole-4-carboxamide

C25H31N5O5S (513.2046)


   

2-[(1R,3R,4aR,9aS)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1R,3R,4aR,9aS)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

2-[(1R,3S,4aR,9aS)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1R,3S,4aR,9aS)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

2-[(1R,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1R,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

N-[(2S,4aS,12aS)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

N-[(2S,4aS,12aS)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

C25H31N5O5S (513.2046)


   

N-[(2R,4aS,12aS)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

N-[(2R,4aS,12aS)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

C25H31N5O5S (513.2046)


   

2-[(1S,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1S,3S,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

2-[(1S,3R,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1S,3R,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

2-[(1R,3R,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1R,3R,4aS,9aR)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

2-[(1S,3R,4aR,9aS)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

2-[(1S,3R,4aR,9aS)-6-[[(cyclopentylamino)-oxomethyl]amino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide

C27H32ClN3O5 (513.203)


   

N-[(2S,4aS,12aR)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

N-[(2S,4aS,12aR)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

C25H31N5O5S (513.2046)


   

N-[(2R,4aR,12aR)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

N-[(2R,4aR,12aR)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

C25H31N5O5S (513.2046)


   

N-[(2R,4aS,12aR)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

N-[(2R,4aS,12aR)-5-methyl-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-thiazolecarboxamide

C25H31N5O5S (513.2046)


   

[(1R)-2-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]methanol

[(1R)-2-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]methanol

C26H31N3O6S (513.1933)


   

[(1S)-2-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]methanol

[(1S)-2-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]methanol

C26H31N3O6S (513.1933)


   

Fuc(a1-3)[Fuc(a1-6)]GlcNAc

Fuc(a1-3)[Fuc(a1-6)]GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Gal(b1-3)QuiNAc

Fuc(a1-2)Gal(b1-3)QuiNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Fuc(a1-4)GlcNAc

Fuc(a1-2)Fuc(a1-4)GlcNAc

C20H35NO14 (513.2057)


   

Col(a1-2)Gal(b1-4)GlcNAc

Col(a1-2)Gal(b1-4)GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Gal(b1-4)3-deoxy-b-D-xylHexNAc

Fuc(a1-2)Gal(b1-4)3-deoxy-b-D-xylHexNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)3-deoxy-D-xylHex(b1-4)b-GlcNAc

Fuc(a1-2)3-deoxy-D-xylHex(b1-4)b-GlcNAc

C20H35NO14 (513.2057)


   

2,6-deoxy-L-lyxHex(a1-2)Gal(b1-4)b-GlcNAc

2,6-deoxy-L-lyxHex(a1-2)Gal(b1-4)b-GlcNAc

C20H35NO14 (513.2057)


   

Gal(b1-3)[Fuc(a1-4)]QuiNAc

Gal(b1-3)[Fuc(a1-4)]QuiNAc

C20H35NO14 (513.2057)


   

4-deoxy-D-xylHex(b1-3)[Fuc(a1-4)]b-GlcNAc

4-deoxy-D-xylHex(b1-3)[Fuc(a1-4)]b-GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Gal(b1-4)3-deoxy-D-xylHexNAc

Fuc(a1-2)Gal(b1-4)3-deoxy-D-xylHexNAc

C20H35NO14 (513.2057)


   

Fuc(a1-4)[Fuc(a1-6)]b-GlcNAc

Fuc(a1-4)[Fuc(a1-6)]b-GlcNAc

C20H35NO14 (513.2057)


   

Gal(b1-3)[4,6-deoxy-L-xylHex(a1-4)]b-GlcNAc

Gal(b1-3)[4,6-deoxy-L-xylHex(a1-4)]b-GlcNAc

C20H35NO14 (513.2057)


   

Gal(b1-3)[Col(a1-4)]b-GlcNAc

Gal(b1-3)[Col(a1-4)]b-GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Gal(b1-3)4-deoxy-D-xylHexNAc

Fuc(a1-2)Gal(b1-3)4-deoxy-D-xylHexNAc

C20H35NO14 (513.2057)


   

Gal(b1-3)[2,6-deoxy-L-lyxHex(a1-4)]GlcNAc

Gal(b1-3)[2,6-deoxy-L-lyxHex(a1-4)]GlcNAc

C20H35NO14 (513.2057)


   

2,6-deoxy-L-lyxHex(a1-2)Gal(b1-4)GlcNAc

2,6-deoxy-L-lyxHex(a1-2)Gal(b1-4)GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)3-deoxy-D-xylHex(b1-3)b-GlcNAc

Fuc(a1-2)3-deoxy-D-xylHex(b1-3)b-GlcNAc

C20H35NO14 (513.2057)


   

4,6-deoxy-L-xylHex(a1-2)Gal(b1-4)b-GlcNAc

4,6-deoxy-L-xylHex(a1-2)Gal(b1-4)b-GlcNAc

C20H35NO14 (513.2057)


   

Gal(b1-3)[4,6-deoxy-L-xylHex(a1-4)]GlcNAc

Gal(b1-3)[4,6-deoxy-L-xylHex(a1-4)]GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-4)[Fuc(a1-6)]GlcNAc

Fuc(a1-4)[Fuc(a1-6)]GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-3)[Fuc(a1-6)]b-GlcNAc

Fuc(a1-3)[Fuc(a1-6)]b-GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Gal(b1-3)4-deoxy-b-D-xylHexNAc

Fuc(a1-2)Gal(b1-3)4-deoxy-b-D-xylHexNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Gal(b1-3)b-QuiNAc

Fuc(a1-2)Gal(b1-3)b-QuiNAc

C20H35NO14 (513.2057)


   

3-deoxy-D-xylHex(b1-3)[Fuc(a1-4)]b-GlcNAc

3-deoxy-D-xylHex(b1-3)[Fuc(a1-4)]b-GlcNAc

C20H35NO14 (513.2057)


   

Col(a1-2)Gal(b1-3)b-GlcNAc

Col(a1-2)Gal(b1-3)b-GlcNAc

C20H35NO14 (513.2057)


   

Gal(b1-3)[2,6-deoxy-L-lyxHex(a1-4)]b-GlcNAc

Gal(b1-3)[2,6-deoxy-L-lyxHex(a1-4)]b-GlcNAc

C20H35NO14 (513.2057)


   

4,6-deoxy-L-xylHex(a1-2)Gal(b1-4)GlcNAc

4,6-deoxy-L-xylHex(a1-2)Gal(b1-4)GlcNAc

C20H35NO14 (513.2057)


   

Col(a1-2)Gal(b1-4)b-GlcNAc

Col(a1-2)Gal(b1-4)b-GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)Fuc(a1-4)b-GlcNAc

Fuc(a1-2)Fuc(a1-4)b-GlcNAc

C20H35NO14 (513.2057)


   

Fuc(a1-2)4-deoxy-D-xylHex(b1-4)b-GlcNAc

Fuc(a1-2)4-deoxy-D-xylHex(b1-4)b-GlcNAc

C20H35NO14 (513.2057)


   

2-(hydroxymethyl)-6-{[2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol

2-(hydroxymethyl)-6-{[2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol

C20H35NO14 (513.2057)


   
   

CCT196969

CCT196969

C27H24FN7O3 (513.1925)


CCT196969 is a pan-Raf inhibitor, which inhibits B-Raf, BRafV600E and CRAF with IC50s of 0.1, 0.04, and 0.01 μM, respectively.

   

10-[(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy]-8,11-dihydroxy-8-(1-hydroxyethyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

10-[(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy]-8,11-dihydroxy-8-(1-hydroxyethyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

C27H31NO9 (513.1999)


   

10-bromo-n-(5-ethyl-5-methyl-2-oxofuran-3-yl)-3,9-dihydroxyoctadeca-4,6-dienimidic acid

10-bromo-n-(5-ethyl-5-methyl-2-oxofuran-3-yl)-3,9-dihydroxyoctadeca-4,6-dienimidic acid

C25H40BrNO5 (513.209)


   

(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-{[(1s,2r,4r,5r,6r)-2,5,6-trihydroxy-2-(hydroxymethyl)-4-{[(1r,4r,5r,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol

(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-{[(1s,2r,4r,5r,6r)-2,5,6-trihydroxy-2-(hydroxymethyl)-4-{[(1r,4r,5r,6s)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol

C20H35NO14 (513.2057)


   

(2s,3s,4r,5s,6s)-2-{[(2e)-4-({9-[(2s,3r,4s,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2s,3s,4r,5s,6s)-2-{[(2e)-4-({9-[(2s,3r,4s,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C21H31N5O10 (513.2071)


   

[(4s,5r,6r,7s,8s,9s)-8-[(3-acetylphenyl)amino]-9-amino-2,6,7-trihydroxy-4,6-dimethyl-3-oxa-1-azaspiro[4.4]non-1-en-7-yl]methyl 2-hydroxy-6-methylbenzoate

[(4s,5r,6r,7s,8s,9s)-8-[(3-acetylphenyl)amino]-9-amino-2,6,7-trihydroxy-4,6-dimethyl-3-oxa-1-azaspiro[4.4]non-1-en-7-yl]methyl 2-hydroxy-6-methylbenzoate

C26H31N3O8 (513.2111)


   

(2r,3r,4s,5s,6r)-2-{[(2e)-4-({9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-{[(2e)-4-({9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C21H31N5O10 (513.2071)


   

(2s,3r,4r,5s,6s)-2-(hydroxymethyl)-6-{[(1r,2r,3s,4r,5r,6s)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[(1r,4s,5r,6r)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol

(2s,3r,4r,5s,6s)-2-(hydroxymethyl)-6-{[(1r,2r,3s,4r,5r,6s)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[(1r,4s,5r,6r)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol

C20H35NO14 (513.2057)


   

{8-[(3-acetylphenyl)amino]-9-amino-2,6,7-trihydroxy-4,6-dimethyl-3-oxa-1-azaspiro[4.4]non-1-en-7-yl}methyl 2-hydroxy-6-methylbenzoate

{8-[(3-acetylphenyl)amino]-9-amino-2,6,7-trihydroxy-4,6-dimethyl-3-oxa-1-azaspiro[4.4]non-1-en-7-yl}methyl 2-hydroxy-6-methylbenzoate

C26H31N3O8 (513.2111)


   

(1s,8s,10s,11r,12s,13s)-3-hydroxy-4,11,12-trimethoxy-18-oxa-17-azapentacyclo[8.4.3.1⁸,¹¹.0¹,¹⁰.0²,⁷]octadeca-2,4,6-trien-13-yl 4-hydroxy-3-methoxybenzoate

(1s,8s,10s,11r,12s,13s)-3-hydroxy-4,11,12-trimethoxy-18-oxa-17-azapentacyclo[8.4.3.1⁸,¹¹.0¹,¹⁰.0²,⁷]octadeca-2,4,6-trien-13-yl 4-hydroxy-3-methoxybenzoate

C27H31NO9 (513.1999)


   

(8r,10r)-10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-6,8,11-trihydroxy-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

(8r,10r)-10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8-ethyl-6,8,11-trihydroxy-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

C27H31NO9 (513.1999)


   

2-{[4-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

2-{[4-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl}amino)-2-methylbut-2-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C21H31N5O10 (513.2071)


   

10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8,11-dihydroxy-8-(1-hydroxyethyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8,11-dihydroxy-8-(1-hydroxyethyl)-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

C27H31NO9 (513.1999)


   

(4e,6z)-10-bromo-n-(5-ethyl-5-methyl-2-oxofuran-3-yl)-3,9-dihydroxyoctadeca-4,6-dienimidic acid

(4e,6z)-10-bromo-n-(5-ethyl-5-methyl-2-oxofuran-3-yl)-3,9-dihydroxyoctadeca-4,6-dienimidic acid

C25H40BrNO5 (513.209)


   

(8s,10s)-10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8,11-dihydroxy-8-[(1s)-1-hydroxyethyl]-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

(8s,10s)-10-{[(2r,4s,5s,6s)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-8,11-dihydroxy-8-[(1s)-1-hydroxyethyl]-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

C27H31NO9 (513.1999)