Exact Mass: 587.2719251999999
Exact Mass Matches: 587.2719251999999
Found 453 metabolites which its exact mass value is equals to given mass value 587.2719251999999
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
N-Acetyl-D-glucosaminyldiphosphodolichol
C23H43NO12P2 (587.2260378000001)
This compound is an intermediate in N-glycan biosynthesis, and the byproduct of N-acetylglucosaminyldiphosphodolichol (EC 2.4.1.141) and UDP-N-acetylglucosamine-dolichyl-phosphate (EC 2.7.8.15). (KEGG) This compound and its corresponding enzymes are implicated in the developmental programmes of a variety of eukaryotes. (PMID: 10024536) [HMDB] This compound is an intermediate in N-glycan biosynthesis, and the byproduct of N-acetylglucosaminyldiphosphodolichol (EC 2.4.1.141) and UDP-N-acetylglucosamine-dolichyl-phosphate (EC 2.7.8.15). (KEGG) This compound and its corresponding enzymes are implicated in the developmental programmes of a variety of eukaryotes. (PMID: 10024536).
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
Brominated Phosphatidylcholine C24H47BrNO8 - putative - Functions on the acyl moity have unknown location
Brominated Phosphatidylcholine mz 2+ C24H47BrNO8 - putative - Functions on the acyl moity have unknown location
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 Gln Tyr Tyr
Asp Tyr Lys Tyr
Asp Tyr Gln Tyr
Asp Tyr Tyr Lys
Asp Tyr Tyr Gln
Glu Phe His Arg
Glu Phe Arg His
Glu His Phe Arg
Glu His Arg Phe
Glu Asn Tyr Tyr
Glu Arg Phe His
Glu Arg His Phe
Glu Arg Gln Arg
Glu Arg Arg Gln
Glu Tyr Asn Tyr
Glu Tyr Tyr Asn
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
C27H41N9O6 (587.3179646000001)
His Ile Tyr Arg
C27H41N9O6 (587.3179646000001)
His Leu Arg Tyr
C27H41N9O6 (587.3179646000001)
His Leu Tyr Arg
C27H41N9O6 (587.3179646000001)
His Arg Glu Phe
His Arg Phe Glu
His Arg Ile Tyr
C27H41N9O6 (587.3179646000001)
His Arg Leu Tyr
C27H41N9O6 (587.3179646000001)
His Arg Tyr Ile
C27H41N9O6 (587.3179646000001)
His Arg Tyr Leu
C27H41N9O6 (587.3179646000001)
His Val Phe Trp
His Val Trp Phe
His Trp Phe Val
His Trp Val Phe
His Tyr Ile Arg
C27H41N9O6 (587.3179646000001)
His Tyr Leu Arg
C27H41N9O6 (587.3179646000001)
His Tyr Arg Ile
C27H41N9O6 (587.3179646000001)
His Tyr Arg Leu
C27H41N9O6 (587.3179646000001)
Ile His Arg Tyr
C27H41N9O6 (587.3179646000001)
Ile His Tyr Arg
C27H41N9O6 (587.3179646000001)
Ile Asn Arg Trp
C27H41N9O6 (587.3179646000001)
Ile Asn Trp Arg
C27H41N9O6 (587.3179646000001)
Ile Arg His Tyr
C27H41N9O6 (587.3179646000001)
Ile Arg Asn Trp
C27H41N9O6 (587.3179646000001)
Ile Arg Trp Asn
C27H41N9O6 (587.3179646000001)
Ile Arg Tyr His
C27H41N9O6 (587.3179646000001)
Ile Trp Asn Arg
C27H41N9O6 (587.3179646000001)
Ile Trp Arg Asn
C27H41N9O6 (587.3179646000001)
Ile Tyr His Arg
C27H41N9O6 (587.3179646000001)
Ile Tyr Arg His
C27H41N9O6 (587.3179646000001)
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
C27H41N9O6 (587.3179646000001)
Leu His Tyr Arg
C27H41N9O6 (587.3179646000001)
Leu Asn Arg Trp
C27H41N9O6 (587.3179646000001)
Leu Asn Trp Arg
C27H41N9O6 (587.3179646000001)
Leu Arg His Tyr
C27H41N9O6 (587.3179646000001)
Leu Arg Asn Trp
C27H41N9O6 (587.3179646000001)
Leu Arg Trp Asn
C27H41N9O6 (587.3179646000001)
Leu Arg Tyr His
C27H41N9O6 (587.3179646000001)
Leu Trp Asn Arg
C27H41N9O6 (587.3179646000001)
Leu Trp Arg Asn
C27H41N9O6 (587.3179646000001)
Leu Tyr His Arg
C27H41N9O6 (587.3179646000001)
Leu Tyr Arg His
C27H41N9O6 (587.3179646000001)
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 Glu Tyr Tyr
Asn Ile Arg Trp
C27H41N9O6 (587.3179646000001)
Asn Ile Trp Arg
C27H41N9O6 (587.3179646000001)
Asn Leu Arg Trp
C27H41N9O6 (587.3179646000001)
Asn Leu Trp Arg
C27H41N9O6 (587.3179646000001)
Asn Arg Ile Trp
C27H41N9O6 (587.3179646000001)
Asn Arg Leu Trp
C27H41N9O6 (587.3179646000001)
Asn Arg Trp Ile
C27H41N9O6 (587.3179646000001)
Asn Arg Trp Leu
C27H41N9O6 (587.3179646000001)
Asn Trp Ile Arg
C27H41N9O6 (587.3179646000001)
Asn Trp Leu Arg
C27H41N9O6 (587.3179646000001)
Asn Trp Arg Ile
C27H41N9O6 (587.3179646000001)
Asn Trp Arg Leu
C27H41N9O6 (587.3179646000001)
Asn Tyr Glu Tyr
Asn Tyr Tyr Glu
Gln Asp Tyr Tyr
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
C27H41N9O6 (587.3179646000001)
Gln Arg Trp Val
C27H41N9O6 (587.3179646000001)
Gln Val Arg Trp
C27H41N9O6 (587.3179646000001)
Gln Val Trp Arg
C27H41N9O6 (587.3179646000001)
Gln Trp Arg Val
C27H41N9O6 (587.3179646000001)
Gln Trp Val Arg
C27H41N9O6 (587.3179646000001)
Gln Tyr Asp Tyr
Gln Tyr Phe Met
Gln Tyr Met Phe
Gln Tyr Tyr Asp
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
C27H41N9O6 (587.3179646000001)
Arg His Leu Tyr
C27H41N9O6 (587.3179646000001)
Arg His Tyr Ile
C27H41N9O6 (587.3179646000001)
Arg His Tyr Leu
C27H41N9O6 (587.3179646000001)
Arg Ile His Tyr
C27H41N9O6 (587.3179646000001)
Arg Ile Asn Trp
C27H41N9O6 (587.3179646000001)
Arg Ile Trp Asn
C27H41N9O6 (587.3179646000001)
Arg Ile Tyr His
C27H41N9O6 (587.3179646000001)
Arg Leu His Tyr
C27H41N9O6 (587.3179646000001)
Arg Leu Asn Trp
C27H41N9O6 (587.3179646000001)
Arg Leu Trp Asn
C27H41N9O6 (587.3179646000001)
Arg Leu Tyr His
C27H41N9O6 (587.3179646000001)
Arg Asn Ile Trp
C27H41N9O6 (587.3179646000001)
Arg Asn Leu Trp
C27H41N9O6 (587.3179646000001)
Arg Asn Trp Ile
C27H41N9O6 (587.3179646000001)
Arg Asn Trp Leu
C27H41N9O6 (587.3179646000001)
Arg Gln Glu Arg
Arg Gln Arg Glu
Arg Gln Val Trp
C27H41N9O6 (587.3179646000001)
Arg Gln Trp Val
C27H41N9O6 (587.3179646000001)
Arg Arg Glu Gln
Arg Arg Gln Glu
Arg Ser Tyr Tyr
C27H37N7O8 (587.2703482000001)
Arg Val Gln Trp
C27H41N9O6 (587.3179646000001)
Arg Val Trp Gln
C27H41N9O6 (587.3179646000001)
Arg Trp Ile Asn
C27H41N9O6 (587.3179646000001)
Arg Trp Leu Asn
C27H41N9O6 (587.3179646000001)
Arg Trp Asn Ile
C27H41N9O6 (587.3179646000001)
Arg Trp Asn Leu
C27H41N9O6 (587.3179646000001)
Arg Trp Gln Val
C27H41N9O6 (587.3179646000001)
Arg Trp Val Gln
C27H41N9O6 (587.3179646000001)
Arg Tyr Cys Phe
Arg Tyr Phe Cys
Arg Tyr His Ile
C27H41N9O6 (587.3179646000001)
Arg Tyr His Leu
C27H41N9O6 (587.3179646000001)
Arg Tyr Ile His
C27H41N9O6 (587.3179646000001)
Arg Tyr Leu His
C27H41N9O6 (587.3179646000001)
Arg Tyr Ser Tyr
C27H37N7O8 (587.2703482000001)
Arg Tyr Tyr Ser
C27H37N7O8 (587.2703482000001)
Ser Arg Tyr Tyr
C27H37N7O8 (587.2703482000001)
Ser Tyr Arg Tyr
C27H37N7O8 (587.2703482000001)
Ser Tyr Tyr Arg
C27H37N7O8 (587.2703482000001)
Val Phe His Trp
Val Phe Trp His
Val His Phe Trp
Val His Trp Phe
Val Gln Arg Trp
C27H41N9O6 (587.3179646000001)
Val Gln Trp Arg
C27H41N9O6 (587.3179646000001)
Val Arg Gln Trp
C27H41N9O6 (587.3179646000001)
Val Arg Trp Gln
C27H41N9O6 (587.3179646000001)
Val Trp Phe His
Val Trp His Phe
Val Trp Gln Arg
C27H41N9O6 (587.3179646000001)
Val Trp Arg Gln
C27H41N9O6 (587.3179646000001)
Trp Phe His Val
Trp Phe Val His
Trp Gly Tyr Tyr
Trp His Phe Val
Trp His Val Phe
Trp Ile Asn Arg
C27H41N9O6 (587.3179646000001)
Trp Ile Arg Asn
C27H41N9O6 (587.3179646000001)
Trp Leu Asn Arg
C27H41N9O6 (587.3179646000001)
Trp Leu Arg Asn
C27H41N9O6 (587.3179646000001)
Trp Asn Ile Arg
C27H41N9O6 (587.3179646000001)
Trp Asn Leu Arg
C27H41N9O6 (587.3179646000001)
Trp Asn Arg Ile
C27H41N9O6 (587.3179646000001)
Trp Asn Arg Leu
C27H41N9O6 (587.3179646000001)
Trp Gln Arg Val
C27H41N9O6 (587.3179646000001)
Trp Gln Val Arg
C27H41N9O6 (587.3179646000001)
Trp Arg Ile Asn
C27H41N9O6 (587.3179646000001)
Trp Arg Leu Asn
C27H41N9O6 (587.3179646000001)
Trp Arg Asn Ile
C27H41N9O6 (587.3179646000001)
Trp Arg Asn Leu
C27H41N9O6 (587.3179646000001)
Trp Arg Gln Val
C27H41N9O6 (587.3179646000001)
Trp Arg Val Gln
C27H41N9O6 (587.3179646000001)
Trp Val Phe His
Trp Val His Phe
Trp Val Gln Arg
C27H41N9O6 (587.3179646000001)
Trp Val Arg Gln
C27H41N9O6 (587.3179646000001)
Trp Tyr Gly Tyr
Trp Tyr Tyr Gly
Tyr Cys Phe Arg
Tyr Cys Arg Phe
Tyr Asp Lys Tyr
Tyr Asp Gln Tyr
Tyr Asp Tyr Lys
Tyr Asp Tyr Gln
Tyr Glu Asn Tyr
Tyr Glu Tyr Asn
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
C27H41N9O6 (587.3179646000001)
Tyr His Leu Arg
C27H41N9O6 (587.3179646000001)
Tyr His Arg Ile
C27H41N9O6 (587.3179646000001)
Tyr His Arg Leu
C27H41N9O6 (587.3179646000001)
Tyr Ile His Arg
C27H41N9O6 (587.3179646000001)
Tyr Ile Arg His
C27H41N9O6 (587.3179646000001)
Tyr Lys Asp Tyr
Tyr Lys Phe Met
Tyr Lys Met Phe
Tyr Lys Tyr Asp
Tyr Leu His Arg
C27H41N9O6 (587.3179646000001)
Tyr Leu Arg His
C27H41N9O6 (587.3179646000001)
Tyr Met Phe Lys
Tyr Met Phe Gln
Tyr Met Lys Phe
Tyr Met Gln Phe
Tyr Asn Glu Tyr
Tyr Asn Tyr Glu
Tyr Gln Asp Tyr
Tyr Gln Phe Met
Tyr Gln Met Phe
Tyr Gln Tyr Asp
Tyr Arg Cys Phe
Tyr Arg Phe Cys
Tyr Arg His Ile
C27H41N9O6 (587.3179646000001)
Tyr Arg His Leu
C27H41N9O6 (587.3179646000001)
Tyr Arg Ile His
C27H41N9O6 (587.3179646000001)
Tyr Arg Leu His
C27H41N9O6 (587.3179646000001)
Tyr Arg Ser Tyr
C27H37N7O8 (587.2703482000001)
Tyr Arg Tyr Ser
C27H37N7O8 (587.2703482000001)
Tyr Ser Arg Tyr
C27H37N7O8 (587.2703482000001)
Tyr Ser Tyr Arg
C27H37N7O8 (587.2703482000001)
Tyr Trp Gly Tyr
Tyr Trp Tyr Gly
Tyr Tyr Asp Lys
Tyr Tyr Asp Gln
Tyr Tyr Glu Asn
Tyr Tyr Gly Trp
Tyr Tyr Lys Asp
Tyr Tyr Asn Glu
Tyr Tyr Gln Asp
Tyr Tyr Arg Ser
C27H37N7O8 (587.2703482000001)
Tyr Tyr Ser Arg
C27H37N7O8 (587.2703482000001)
Tyr Tyr Trp Gly
N-Acetyl-D-glucosaminyldiphosphodolichol
C23H43NO12P2 (587.2260378000001)
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].
5-O-(4,4-Dimethoxytrityl)-N4-acetyl-2-deoxycytidine
C32H33N3O8 (587.2267538000001)
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-Hexadecyl-1-methyl-1H-imidazolium 1,1,1-Trifluoro-N-[(trifluoromethyl)sulfonyl]methanesulfonamide
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-)
C33H39N4O6- (587.2869453999999)
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
C29H41N5O8 (587.2954986000001)
(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$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
N-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2,5-dimethyl-3-pyrazolecarboxamide
C30H36F3N5O4 (587.2719251999999)
1-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
1-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11-methyl-14-oxo-9-oxa-13-azatricyclo[13.4.0.02,7]nonadeca-1(19),2,4,6,15,17-hexaen-10-yl]methyl]-1-methyl-3-(2-morpholin-4-ylpyridin-4-yl)urea
2-[(2R,4aS,12aS)-8-[[[(3,5-dimethyl-4-isoxazolyl)amino]-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-2,5-dimethyl-3-pyrazolecarboxamide
C30H36F3N5O4 (587.2719251999999)
(2R)-2-[(4S,5R)-4-methyl-5-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-1,1-dioxo-8-pyridin-4-yl-4,5-dihydro-3H-6,1$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
C30H36F3N5O4 (587.2719251999999)
(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
C30H41N3O7S (587.2665076000001)
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
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(3-hydroxy-5-oxo-1,7-diphenylheptan-4-yl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)butanoic acid
C29H37N3O8S (587.2301242000001)
5-aminopentyl beta-D-glucopyranosyl-(1->3)-6-deoxy-2-O-methyl-alpha-L-talopyranosyl-(1->3)-beta-D-glucopyranoside
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(2-hydroxy-5-oxo-1,7-diphenylheptyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)butanoic acid
C29H37N3O8S (587.2301242000001)
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(1-hydroxy-5-oxo-1,7-diphenylheptan-2-yl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)butanoic acid
C29H37N3O8S (587.2301242000001)
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-[(4-hydroxy-5-oxo-1,7-diphenylheptan-3-yl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)butanoic acid
C29H37N3O8S (587.2301242000001)
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
[3-hydroxy-2-[(Z)-16-(81Br)bromanyl-5-hydroxyhexadec-12-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
[3-hydroxy-2-[(Z)-16-(79Br)bromanyl-5-hydroxyhexadec-12-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
(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
(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"}
(1s,2r,3r,4r,5s,6s,8s,9s,10r,13s,16s,17s)-11-ethyl-5,8,17-trihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate
6-hydroxy-8-methyl-7-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-3-yl 3,4,5-trimethoxybenzoate
(1-{[(1s)-1-[(1-{[(1s)-1-carboxyethyl]-c-hydroxycarbonimidoyl}-2-hydroxy-3-methylbutyl)-c-hydroxycarbonimidoyl]-2-(4-hydroxyphenyl)ethyl]-c-hydroxycarbonimidoyl}-2-(4-hydroxyphenyl)ethyl)trimethylazanium
(1r,2r,3r,4s,5s,6s,8s,9r,10s,13s,14r,16r,17r)-11-ethyl-5,8,14-trihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate
(1s,3s,5s,7r,10r,12s,14r,15s,18r,19r,23r)-10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-5'h-4,6,11-trioxaspiro[hexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacosane-9,2'-[1,3]thiazole]-14-carbaldehyde
C31H41NO8S (587.2552746000001)
14,26-dihydroxy-2-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-9,9,16,16-tetramethyl-8-oxa-14,23,25-triazaheptacyclo[17.5.2.0¹,¹⁷.0³,¹⁵.0⁴,¹³.0⁷,¹².0¹⁹,²³]hexacosa-3(15),4,6,10,12,25-hexaen-24-one
C32H33N3O8 (587.2267538000001)
20-[2-ethoxy-2-(2,4,5-trimethoxyphenyl)ethyl]-17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaene
(20r)-20-[(2s)-2-ethoxy-2-(2,4,5-trimethoxyphenyl)ethyl]-17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁴,¹⁹]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaene
7-hydroxy-8-methyl-3-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-6-yl 3,4,5-trimethoxybenzoate
(1r,2s,17s,19s)-14,26-dihydroxy-2-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-9,9,16,16-tetramethyl-8-oxa-14,23,25-triazaheptacyclo[17.5.2.0¹,¹⁷.0³,¹⁵.0⁴,¹³.0⁷,¹².0¹⁹,²³]hexacosa-3(15),4,6,10,12,25-hexaen-24-one
C32H33N3O8 (587.2267538000001)
(1s,3s,5r,6r,7r)-7-hydroxy-8-methyl-3-{[(2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-6-yl 3,4,5-trimethoxybenzoate
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
(1s,4s,9s,10s,25s,26r)-4,22-dihydroxy-7-(hydroxymethyl)-17,17,24,24-tetramethyl-8,16-dioxa-3,22,28-triazanonacyclo[23.6.1.0¹,²⁸.0³,²⁶.0⁴,⁹.0¹⁰,²⁶.0¹¹,²³.0¹²,²¹.0¹⁵,²⁰]dotriaconta-6,11(23),12,14,18,20-hexaene-2,5,27-trione
C32H33N3O8 (587.2267538000001)
(1r,3r,4s,5r,8s,9r,10r,11r,14r,16s,17r,18r,19r)-4,10,19-tris(acetyloxy)-9,18-dihydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-3-yl (2r)-2-methylbutanoate
C31H41NO10 (587.2730326000001)
(1s,3r,5s,7r,9r,10r,12r,14r,15s,18r,19r,22s,23r)-10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-5'h-4,6,11-trioxaspiro[hexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacosane-9,2'-[1,3]thiazole]-14-carbaldehyde
C31H41NO8S (587.2552746000001)
(1s,2r,3r,4s,5r,6s,8r,9r,10r,12s,13r,16s,17s,18r)-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
(1s,2r,3r,4r,5s,6s,8r,9r,10r,13r,14r,16s,17s,18r)-11-ethyl-5,8,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate
(1s,3r,5s,7r,9s,10r,12r,14r,15s,18r,19s,22s,23r)-10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-5'h-4,6,11-trioxaspiro[hexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacosane-9,2'-[1,3]thiazole]-14-carbaldehyde
C31H41NO8S (587.2552746000001)
(7s,8r,9r,10r)-7-{[(2s,4s,5r,6r)-4-(dimethylamino)-5-hydroxy-4,6-dimethyloxan-2-yl]oxy}-4,6,9,10-tetrahydroxy-1,8-dimethoxy-9-methyl-8,10-dihydro-7h-tetracene-5,12-dione
(1r,2s,3s,4r,5r,6s,7s,8s,9r,10r,13s,17r,18r)-8-(acetyloxy)-2,5,7-trihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate
C31H41NO10 (587.2730326000001)
(2r,3r,4r,5s,6s,8r,13r,14r,16s,17s,18r)-11-ethyl-5,8,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate
10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-5'h-4,6,11-trioxaspiro[hexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacosane-9,2'-[1,3]thiazole]-14-carbaldehyde
C31H41NO8S (587.2552746000001)
(1s,3s,5r,6r,7s)-7-hydroxy-8-methyl-3-{[(2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-6-yl 3,4,5-trimethoxybenzoate
(1r,3r,4s,5r,8s,9r,10r,11r,14r,16s,17r,18r,19r)-4,10,19-tris(acetyloxy)-9,18-dihydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-3-yl (2s)-2-methylbutanoate
C31H41NO10 (587.2730326000001)
11-ethyl-5,8,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate
(1s,3r,5r,6r,7s)-7-hydroxy-8-methyl-3-{[(2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-8-azabicyclo[3.2.1]octan-6-yl 3,4,5-trimethoxybenzoate
(1r,3s,5s,6r,7s)-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
4,10,19-tris(acetyloxy)-9,18-dihydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-3-yl 2-methylbutanoate
C31H41NO10 (587.2730326000001)
(1s,3r,5s,7r,9s,10r,12r,14r,15r,18r,19r,22s,23r)-10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-5'h-4,6,11-trioxaspiro[hexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacosane-9,2'-[1,3]thiazole]-14-carbaldehyde
C31H41NO8S (587.2552746000001)
4,22-dihydroxy-7-(hydroxymethyl)-17,17,24,24-tetramethyl-8,16-dioxa-3,22,28-triazanonacyclo[23.6.1.0¹,²⁸.0³,²⁶.0⁴,⁹.0¹⁰,²⁶.0¹¹,²³.0¹²,²¹.0¹⁵,²⁰]dotriaconta-6,11(23),12,14,18,20-hexaene-2,5,27-trione
C32H33N3O8 (587.2267538000001)