Exact Mass: 587.2859
Exact Mass Matches: 587.2859
Found 440 metabolites which its exact mass value is equals to given mass value 587.2859
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
7-(3-((3-Acetylphenoxy)methyl)-1,5-dimethyl-1H-pyrazol-4-yl)-3-(3-(naphthalen-1-yloxy)propyl)-1H-indole-2-carboxylic acid
Glu-Ile-Leu-Asp-Val
H-Gly-Arg-Gly-Asp-D-Ser-Pro-OH
GRGDSP, a synthetic linear RGD peptide, is an integrin inhibitor.
Retaspimycin
Ludaconitine
Nothramicin
An anthracycline antibiotic isolated from the culture broth of Nocardia sp. MJ896-43F17. It exhibits significant antimycobacterial activity against several drug-resistant Mycobacterium smegmatis strains.
(1alpha,6alpha,14alpha,16beta)-20-ethyl-1,6,8-trihydroxy-16-methoxy-4-(methoxymethyl)aconitan-14-yl 3,4-dimethoxybenzoate|6-hydroxy-14-O-veratroylneoline|hemsleyaconitine B
7beta-hydroxy-6beta-(3,4,5-trimethoxybenzoyloxy)-3alpha-(E)-(3,4,5-trimethoxycinnamoyloxy)tropane
6-[2-ethoxy-2-(2,4,5-trimethoxyphenyl)]ethyl-7,8-dimethoxy-5-methyl-2,3-methylenedioxy-5,6-dihydrobenzo[c]phenanthridine|buesgeniine
Glu Gln Arg Arg
Ala Arg Arg Trp
Ala Arg Trp Arg
Ala Trp Arg Arg
Cys Phe Arg Tyr
Cys Phe Tyr Arg
Cys Arg Phe Tyr
Cys Arg Tyr Phe
Cys Tyr Phe Arg
Cys Tyr Arg Phe
Asp Lys Tyr Tyr
Asp Tyr Lys Tyr
Asp Tyr Tyr Lys
Glu Phe His Arg
Glu Phe Arg His
Glu His Phe Arg
Glu His Arg Phe
Glu Arg Phe His
Glu Arg His Phe
Glu Arg Gln Arg
Glu Arg Arg Gln
Phe Cys Arg Tyr
Phe Cys Tyr Arg
Phe Glu His Arg
Phe Glu Arg His
Phe Phe Phe Lys
Phe Phe Phe Gln
Phe Phe Lys Phe
Phe Phe Gln Phe
Phe His Glu Arg
Phe His Arg Glu
Phe His Val Trp
Phe His Trp Val
Phe Lys Phe Phe
Phe Lys Met Tyr
Phe Lys Tyr Met
Phe Met Lys Tyr
Phe Met Gln Tyr
Phe Met Tyr Lys
Phe Met Tyr Gln
Phe Gln Phe Phe
Phe Gln Met Tyr
Phe Gln Tyr Met
Phe Arg Cys Tyr
Phe Arg Glu His
Phe Arg His Glu
Phe Arg Tyr Cys
Phe Val His Trp
Phe Val Trp His
Phe Trp His Val
Phe Trp Val His
Phe Tyr Cys Arg
Phe Tyr Lys Met
Phe Tyr Met Lys
Phe Tyr Met Gln
Phe Tyr Gln Met
Phe Tyr Arg Cys
Gly Trp Tyr Tyr
Gly Tyr Trp Tyr
Gly Tyr Tyr Trp
His Glu Phe Arg
His Glu Arg Phe
His Phe Glu Arg
His Phe Arg Glu
His Phe Val Trp
His Phe Trp Val
His Ile Arg Tyr
His Ile Tyr Arg
His Leu Arg Tyr
His Leu Tyr Arg
His Arg Glu Phe
His Arg Phe Glu
His Arg Ile Tyr
His Arg Leu Tyr
His Arg Tyr Ile
His Arg Tyr Leu
His Val Phe Trp
His Val Trp Phe
His Trp Phe Val
His Trp Val Phe
His Tyr Ile Arg
His Tyr Leu Arg
His Tyr Arg Ile
His Tyr Arg Leu
Ile His Arg Tyr
Ile His Tyr Arg
Ile Asn Arg Trp
Ile Asn Trp Arg
Ile Arg His Tyr
Ile Arg Asn Trp
Ile Arg Trp Asn
Ile Arg Tyr His
Ile Trp Asn Arg
Ile Trp Arg Asn
Ile Tyr His Arg
Ile Tyr Arg His
Lys Asp Tyr Tyr
Lys Phe Phe Phe
Lys Phe Met Tyr
Lys Phe Tyr Met
Lys Met Phe Tyr
Lys Met Tyr Phe
Lys Tyr Asp Tyr
Lys Tyr Phe Met
Lys Tyr Met Phe
Lys Tyr Tyr Asp
Leu His Arg Tyr
Leu His Tyr Arg
Leu Asn Arg Trp
Leu Asn Trp Arg
Leu Arg His Tyr
Leu Arg Asn Trp
Leu Arg Trp Asn
Leu Arg Tyr His
Leu Trp Asn Arg
Leu Trp Arg Asn
Leu Tyr His Arg
Leu Tyr Arg His
Met Phe Lys Tyr
Met Phe Gln Tyr
Met Phe Tyr Lys
Met Phe Tyr Gln
Met Lys Phe Tyr
Met Lys Tyr Phe
Met Gln Phe Tyr
Met Gln Tyr Phe
Met Tyr Phe Lys
Met Tyr Phe Gln
Met Tyr Lys Phe
Met Tyr Gln Phe
Asn Ile Arg Trp
Asn Ile Trp Arg
Asn Leu Arg Trp
Asn Leu Trp Arg
Asn Arg Ile Trp
Asn Arg Leu Trp
Asn Arg Trp Ile
Asn Arg Trp Leu
Asn Trp Ile Arg
Asn Trp Leu Arg
Asn Trp Arg Ile
Asn Trp Arg Leu
Gln Glu Arg Arg
Gln Phe Phe Phe
Gln Phe Met Tyr
Gln Phe Tyr Met
Gln Met Phe Tyr
Gln Met Tyr Phe
Gln Arg Glu Arg
Gln Arg Arg Glu
Gln Arg Val Trp
Gln Arg Trp Val
Gln Val Arg Trp
Gln Val Trp Arg
Gln Trp Arg Val
Gln Trp Val Arg
Gln Tyr Phe Met
Gln Tyr Met Phe
Arg Ala Arg Trp
Arg Ala Trp Arg
Arg Cys Phe Tyr
Arg Cys Tyr Phe
Arg Glu Phe His
Arg Glu His Phe
Arg Glu Gln Arg
Arg Glu Arg Gln
Arg Phe Cys Tyr
Arg Phe Glu His
Arg Phe His Glu
Arg Phe Tyr Cys
Arg His Glu Phe
Arg His Phe Glu
Arg His Ile Tyr
Arg His Leu Tyr
Arg His Tyr Ile
Arg His Tyr Leu
Arg Ile His Tyr
Arg Ile Asn Trp
Arg Ile Trp Asn
Arg Ile Tyr His
Arg Leu His Tyr
Arg Leu Asn Trp
Arg Leu Trp Asn
Arg Leu Tyr His
Arg Asn Ile Trp
Arg Asn Leu Trp
Arg Asn Trp Ile
Arg Asn Trp Leu
Arg Gln Glu Arg
Arg Gln Arg Glu
Arg Gln Val Trp
Arg Gln Trp Val
Arg Arg Ala Trp
Arg Arg Glu Gln
Arg Arg Gln Glu
Arg Arg Trp Ala
Arg Ser Tyr Tyr
Arg Val Gln Trp
Arg Val Trp Gln
Arg Trp Ala Arg
Arg Trp Ile Asn
Arg Trp Leu Asn
Arg Trp Asn Ile
Arg Trp Asn Leu
Arg Trp Gln Val
Arg Trp Arg Ala
Arg Trp Val Gln
Arg Tyr Cys Phe
Arg Tyr Phe Cys
Arg Tyr His Ile
Arg Tyr His Leu
Arg Tyr Ile His
Arg Tyr Leu His
Arg Tyr Ser Tyr
Arg Tyr Tyr Ser
Ser Arg Tyr Tyr
Ser Tyr Arg Tyr
Ser Tyr Tyr Arg
Val Phe His Trp
Val Phe Trp His
Val His Phe Trp
Val His Trp Phe
Val Gln Arg Trp
Val Gln Trp Arg
Val Arg Gln Trp
Val Arg Trp Gln
Val Trp Phe His
Val Trp His Phe
Val Trp Gln Arg
Val Trp Arg Gln
Trp Ala Arg Arg
Trp Phe His Val
Trp Phe Val His
Trp Gly Tyr Tyr
Trp His Phe Val
Trp His Val Phe
Trp Ile Asn Arg
Trp Ile Arg Asn
Trp Leu Asn Arg
Trp Leu Arg Asn
Trp Asn Ile Arg
Trp Asn Leu Arg
Trp Asn Arg Ile
Trp Asn Arg Leu
Trp Gln Arg Val
Trp Gln Val Arg
Trp Arg Ala Arg
Trp Arg Ile Asn
Trp Arg Leu Asn
Trp Arg Asn Ile
Trp Arg Asn Leu
Trp Arg Gln Val
Trp Arg Arg Ala
Trp Arg Val Gln
Trp Val Phe His
Trp Val His Phe
Trp Val Gln Arg
Trp Val Arg Gln
Trp Tyr Gly Tyr
Trp Tyr Tyr Gly
Tyr Cys Phe Arg
Tyr Cys Arg Phe
Tyr Asp Lys Tyr
Tyr Asp Tyr Lys
Tyr Phe Cys Arg
Tyr Phe Lys Met
Tyr Phe Met Lys
Tyr Phe Met Gln
Tyr Phe Gln Met
Tyr Phe Arg Cys
Tyr Gly Trp Tyr
Tyr Gly Tyr Trp
Tyr His Ile Arg
Tyr His Leu Arg
Tyr His Arg Ile
Tyr His Arg Leu
Tyr Ile His Arg
Tyr Ile Arg His
Tyr Lys Asp Tyr
Tyr Lys Phe Met
Tyr Lys Met Phe
Tyr Lys Tyr Asp
Tyr Leu His Arg
Tyr Leu Arg His
Tyr Met Phe Lys
Tyr Met Phe Gln
Tyr Met Lys Phe
Tyr Met Gln Phe
Tyr Gln Phe Met
Tyr Gln Met Phe
Tyr Arg Cys Phe
Tyr Arg Phe Cys
Tyr Arg His Ile
Tyr Arg His Leu
Tyr Arg Ile His
Tyr Arg Leu His
Tyr Arg Ser Tyr
Tyr Arg Tyr Ser
Tyr Ser Arg Tyr
Tyr Ser Tyr Arg
Tyr Trp Gly Tyr
Tyr Trp Tyr Gly
Tyr Tyr Asp Lys
Tyr Tyr Gly Trp
Tyr Tyr Lys Asp
Tyr Tyr Arg Ser
Tyr Tyr Ser Arg
Tyr Tyr Trp Gly
SCH772984
SCH772984 is a highly selective and ATP-competitive ERK inhibitor, with IC50s of 4 and 1 nM for ERK1 and ERK2, respectively. SCH772984 has antitumor activity in MAPK inhibitor-na?ve and MAPK inhibitor-resistant cells containing BRAF or RAS mutations[1].
Retaspimycin
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C259 - Antineoplastic Antibiotic D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
3-({1-[3-Carbamimidoyl-1-(4-carbamimidoyl-benzylcarbamoyl)-propylcarbamoyl]-2-methyl-butylsulfamoyl}-methyl)-benzoic acid
[(2S)-1-oxo-1-[[(2S,10R,12S,14S)-12,16,19-trihydroxy-7,14,18-trimethoxy-6,17,21-trimethyl-5,8-dioxo-11,21-diazapentacyclo[11.7.1.02,11.04,9.015,20]henicosa-4(9),6,15(20),16,18-pentaen-10-yl]methylamino]propan-2-yl]azanium
[(4E,6Z,10E)-13,20,22-trihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-19-(prop-2-enylamino)-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate
Dinoflagellate luciferin(1-)
The linear tetrapyrrole anion that is dinoflagellate luciferin protonated to pH 7.3.
4-[[[5-[[[(2S)-1-[(2-methylpropan-2-yl)oxy]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexan-2-yl]amino]-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]benzoic acid ethyl ester
(2R)-2-[(4R,5R)-4-methyl-5-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-1,1-dioxo-8-pyridin-4-yl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2,5-dimethyl-3-pyrazolecarboxamide
1-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
2-[(2R,4aS,12aS)-8-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2,5-dimethyl-3-pyrazolecarboxamide
(2R)-2-[(4S,5R)-4-methyl-5-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-1,1-dioxo-8-pyridin-4-yl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
1-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
N-[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2,5-dimethyl-3-pyrazolecarboxamide
(2S)-2-[(4S,5S)-4-methyl-5-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-1,1-dioxo-8-pyridin-4-yl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
(2S)-2-[(4R,5S)-4-methyl-5-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-1,1-dioxo-8-pyridin-4-yl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
(2S)-2-[(4S,5R)-4-methyl-5-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-1,1-dioxo-8-pyridin-4-yl-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-8-(4-methylphenyl)sulfonyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-4-oxanecarboxamide
1-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10R,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
5-aminopentyl beta-D-glucopyranosyl-(1->3)-6-deoxy-2-O-methyl-alpha-L-talopyranosyl-(1->3)-beta-D-glucopyranoside
2-amino-3-[[2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-3-hexanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
2-amino-3-[[3-butanoyloxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
3-[[3-acetyloxy-2-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxy-2-aminopropanoic acid
(3s,6s,7r)-6-hydroxy-8-methyl-7-{[(2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-3-yl 3,4,5-trimethoxybenzoate
1-[(13e)-8,11-dihydroxy-16-methoxy-10-(2-methylpropyl)-2-oxa-6,9,12-triazatricyclo[13.3.1.0³,⁷]nonadeca-1(18),8,11,13,15(19),16-hexaen-6-yl]-2-(dimethylamino)-3-(1h-indol-3-yl)propan-1-one
11-ethyl-8,16,18-trihydroxy-6,12-dimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3,4-dimethoxybenzoate
(3r,9s,12s,18s)-9-benzyl-5,8,11,14,17-pentahydroxy-12-isopropyl-3,18-bis(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclooctadeca-4,7,10,13,16-pentaen-2-one
(2s)-1-[(3s,7s,10s,13z)-8,11-dihydroxy-16-methoxy-10-(sec-butyl)-2-oxa-6,9,12-triazatricyclo[13.3.1.0³,⁷]nonadeca-1(18),8,11,13,15(19),16-hexaen-6-yl]-2-(dimethylamino)-3-(1h-indol-3-yl)propan-1-one
3α-(3,4,5-trimethoxy-cinnamoyloxy)-7β-(3,4,5-trimethoxybenzoyloxy)-6α-hydroxy-tropane
{"Ingredient_id": "HBIN007915","Ingredient_name": "3\u03b1-(3,4,5-trimethoxy-cinnamoyloxy)-7\u03b2-(3,4,5-trimethoxybenzoyloxy)-6\u03b1-hydroxy-tropane","Alias": "NA","Ingredient_formula": "C30H37NO11","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21887","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}