Exact Mass: 533.1969
Exact Mass Matches: 533.1969
Found 379 metabolites which its exact mass value is equals to given mass value 533.1969
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(2r)-1,1,1-Trifluoro-2-{4-[(2s)-2-{[(3s)-3-Methylmorpholin-4-Yl]methyl}-4-(Thiophen-2-Ylsulfonyl)piperazin-1-Yl]phenyl}propan-2-Ol
2,3,9,10-tetramethoxy-4-O-beta-D-glucopyranosyl-tetrahydroprotoberberine|thaicanine-4-O-beta-D-glucopyranoside
7-[(beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranosyl)oxymethy]-8,8-dimethyl-4,8-dihydrobenzo[1,4]thiazine-3,5-dione
14-Deoxy-12-(cysteine-S-yl)-andrographolide-3-O-sulfate
Thr Glu Arg Glu
1,2,3,10-Tetramethoxy-9-(2-hydroxy-4,5-dimethoxybenzyloxy)oxoaporphine
CINEPAZIDE MALEATE
D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
4-[5-chloro-7-(3,5-dihydroxyhexanoyloxy)-3-[(1E,3E,5E)-hepta-1,3,5-trienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]butanoic acid
Ala Glu Glu Trp
Ala Glu Trp Glu
Ala Trp Glu Glu
Cys Glu Pro Trp
Cys Glu Trp Pro
Cys Phe His Lys
Cys Phe His Gln
Cys Phe Lys His
Cys Phe Gln His
Cys His Phe Lys
Cys His Phe Gln
Cys His Lys Phe
Cys His Gln Phe
Cys Lys Phe His
Cys Lys His Phe
Cys Pro Glu Trp
Cys Pro Trp Glu
Cys Gln Phe His
Cys Gln His Phe
Cys Gln Gln Arg
Cys Gln Arg Gln
Cys Arg Gln Gln
Cys Trp Glu Pro
Cys Trp Pro Glu
Asp Asp Glu Arg
Asp Asp Arg Glu
Asp Asp Val Trp
Asp Asp Trp Val
Asp Glu Asp Arg
Asp Glu Arg Asp
Asp Arg Asp Glu
Asp Arg Glu Asp
Asp Val Asp Trp
Asp Val Trp Asp
Asp Trp Asp Val
Asp Trp Val Asp
Glu Ala Glu Trp
Glu Ala Trp Glu
Glu Cys Pro Trp
Glu Cys Trp Pro
Glu Asp Asp Arg
Glu Asp Arg Asp
Glu Glu Ala Trp
Glu Glu Glu Lys
Glu Glu Glu Gln
Glu Glu Lys Glu
Glu Glu Gln Glu
Glu Glu Arg Thr
Glu Glu Thr Arg
Glu Glu Trp Ala
Glu Lys Glu Glu
Glu Pro Cys Trp
Glu Pro Trp Cys
Glu Gln Glu Glu
Glu Arg Asp Asp
Glu Arg Glu Thr
Glu Arg Thr Glu
Glu Thr Glu Arg
Glu Thr Arg Glu
Glu Trp Ala Glu
Glu Trp Cys Pro
Glu Trp Glu Ala
Glu Trp Pro Cys
Phe Cys His Lys
Phe Cys His Gln
Phe Cys Lys His
Phe Cys Gln His
Phe His Cys Lys
Phe His Cys Gln
Phe His Lys Cys
Phe His Gln Cys
Phe Lys Cys His
Phe Lys His Cys
Phe Gln Cys His
Phe Gln His Cys
His Cys Phe Lys
His Cys Phe Gln
His Cys Lys Phe
His Cys Gln Phe
His Phe Cys Lys
His Phe Cys Gln
His Phe Lys Cys
His Phe Gln Cys
His Lys Cys Phe
His Lys Phe Cys
His Asn Thr Tyr
His Asn Tyr Thr
His Gln Cys Phe
His Gln Phe Cys
His Gln Ser Tyr
His Gln Tyr Ser
His Ser Gln Tyr
His Ser Tyr Gln
His Thr Asn Tyr
His Thr Tyr Asn
His Tyr Asn Thr
His Tyr Gln Ser
His Tyr Ser Gln
His Tyr Thr Asn
Lys Cys Phe His
Lys Cys His Phe
Lys Glu Glu Glu
Lys Phe Cys His
Lys Phe His Cys
Lys His Cys Phe
Lys His Phe Cys
Met Met Pro Arg
Met Met Arg Pro
Met Asn Asn Arg
Met Asn Arg Asn
Met Pro Met Arg
Met Pro Arg Met
Met Pro Thr Trp
Met Pro Trp Thr
Met Gln Gln Gln
Met Arg Met Pro
Met Arg Asn Asn
Met Arg Pro Met
Met Thr Pro Trp
Met Thr Trp Pro
Met Trp Pro Thr
Met Trp Thr Pro
Asn His Thr Tyr
Asn His Tyr Thr
Asn Met Asn Arg
Asn Met Arg Asn
Asn Asn Met Arg
Asn Asn Arg Met
Asn Asn Thr Trp
Asn Asn Trp Thr
Asn Gln Ser Trp
Asn Gln Trp Ser
Asn Arg Met Asn
Asn Arg Asn Met
Asn Ser Gln Trp
Asn Ser Trp Gln
Asn Thr His Tyr
Asn Thr Asn Trp
Asn Thr Trp Asn
Asn Thr Tyr His
Asn Trp Asn Thr
Asn Trp Gln Ser
Asn Trp Ser Gln
Asn Trp Thr Asn
Asn Tyr His Thr
Asn Tyr Thr His
Pro Cys Glu Trp
Pro Cys Trp Glu
Pro Glu Cys Trp
Pro Glu Trp Cys
Pro Met Met Arg
Pro Met Arg Met
Pro Met Thr Trp
Pro Met Trp Thr
Pro Arg Met Met
Pro Thr Met Trp
Pro Thr Trp Met
Pro Trp Cys Glu
Pro Trp Glu Cys
Pro Trp Met Thr
Pro Trp Thr Met
Gln Cys Phe His
Gln Cys His Phe
Gln Cys Gln Arg
Gln Cys Arg Gln
Gln Glu Glu Glu
Gln Phe Cys His
Gln Phe His Cys
Gln His Cys Phe
Gln His Phe Cys
Gln His Ser Tyr
Gln His Tyr Ser
Gln Met Gln Gln
Gln Asn Ser Trp
Gln Asn Trp Ser
Gln Gln Cys Arg
Gln Gln Met Gln
Gln Gln Gln Met
Gln Gln Arg Cys
Gln Arg Cys Gln
Gln Arg Gln Cys
Gln Ser His Tyr
Gln Ser Asn Trp
Gln Ser Trp Asn
Gln Ser Tyr His
Gln Trp Asn Ser
Gln Trp Ser Asn
Gln Tyr His Ser
Gln Tyr Ser His
Arg Cys Gln Gln
Arg Asp Asp Glu
Arg Asp Glu Asp
Arg Glu Asp Asp
Arg Glu Glu Thr
Arg Glu Thr Glu
Arg Met Met Pro
Arg Met Asn Asn
Arg Met Pro Met
Arg Asn Met Asn
Arg Asn Asn Met
Arg Pro Met Met
Arg Gln Cys Gln
Arg Gln Gln Cys
Arg Thr Glu Glu
Ser His Gln Tyr
Ser His Tyr Gln
Ser Asn Gln Trp
Ser Asn Trp Gln
Ser Gln His Tyr
Ser Gln Asn Trp
Ser Gln Trp Asn
Ser Gln Tyr His
Ser Trp Asn Gln
Ser Trp Gln Asn
Ser Tyr His Gln
Ser Tyr Gln His
Thr Glu Glu Arg
Thr His Asn Tyr
Thr His Tyr Asn
Thr Met Pro Trp
Thr Met Trp Pro
Thr Asn His Tyr
Thr Asn Asn Trp
Thr Asn Trp Asn
Thr Asn Tyr His
Thr Pro Met Trp
Thr Pro Trp Met
Thr Arg Glu Glu
Thr Trp Met Pro
Thr Trp Asn Asn
Thr Trp Pro Met
Thr Tyr His Asn
Thr Tyr Asn His
Val Asp Asp Trp
Val Asp Trp Asp
Val Trp Asp Asp
Trp Ala Glu Glu
Trp Cys Glu Pro
Trp Cys Pro Glu
Trp Asp Asp Val
Trp Asp Val Asp
Trp Glu Ala Glu
Trp Glu Cys Pro
Trp Glu Glu Ala
Trp Glu Pro Cys
Trp Met Pro Thr
Trp Met Thr Pro
Trp Asn Asn Thr
Trp Asn Gln Ser
Trp Asn Ser Gln
Trp Asn Thr Asn
Trp Pro Cys Glu
Trp Pro Glu Cys
Trp Pro Met Thr
Trp Pro Thr Met
Trp Gln Asn Ser
Trp Gln Ser Asn
Trp Ser Asn Gln
Trp Ser Gln Asn
Trp Thr Met Pro
Trp Thr Asn Asn
Trp Thr Pro Met
Trp Val Asp Asp
Tyr His Asn Thr
Tyr His Gln Ser
Tyr His Ser Gln
Tyr His Thr Asn
Tyr Asn His Thr
Tyr Asn Thr His
Tyr Gln His Ser
Tyr Gln Ser His
Tyr Ser His Gln
Tyr Ser Gln His
Tyr Thr His Asn
Tyr Thr Asn His
Ethyl 1-(2-chlorophenyl)-5-(4-{4-[(3,5-dimethyl-1,2-oxazol-4-yl)c arbonyl]-1-piperazinyl}phenyl)-1H-pyrazole-3-carboxylate
9-[(1S,3R,4S)-2-Methylene-4-(phenylmethoxy)-3-[(phenylmethoxy)methyl]cyclopentyl]-6-(phenylmethoxy)-9H-Purin-2-amine
N-acetylneuraminic Acid Methyl Ester 2,4,7,8,9-Pentaacetate
((4-((4-Amino-m-tolyl)(4-(phenylimino)cyclohexa-2,5-dien-1-ylidene)methyl)phenyl)amino)benzenesulphonic acid
2-Cyclohexyl-N-(2-{4-[5-(2,3-dichloro-phenyl)-2H-pyrazol-3-YL]-piperidin-1-YL}-2-oxo-ethyl)-2-guanidino-acetamide
2-{[4-(2-Acetylamino-2-pentylcarbamoyl-ethyl)-naphthalen-1-YL]-oxalyl-amino}-benzoic acid
(2r)-1,1,1-Trifluoro-2-{4-[(2s)-2-{[(3s)-3-Methylmorpholin-4-Yl]methyl}-4-(Thiophen-2-Ylsulfonyl)piperazin-1-Yl]phenyl}propan-2-Ol
[2-[2-(4-Fluorophenyl)ethylamino]-2-oxoethyl] 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate
[4-[Bis(4-morpholinyl)phosphoryl]-1-methyl-2-pyrrolyl]-bis(4-morpholinyl)-sulfanylidenephosphorane
N-Benzoyl-N-(18-phenyl-11-oxa-13,15-diazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2,4,6,8,12,14,16-octaen-16-yl)benzamide
N-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
gammaGluCys(IAN)Glu
A tripeptide that consists of L-gamma-glutamyl-L-cysteinyl-L-glutamic acid in which the the cysteine side chain is substituted by a cyano(indol-3-yl)methyl group.
N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
N-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
N-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
N-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
N-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
N-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
N-[(2R,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide
N-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
N-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]cyclopropanecarboxamide
N-[(2R,3S)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide
N-[(2R,3R)-2-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]methanesulfonamide
6-[4-(2-{[2-(3,4-dimethoxyphenyl)ethyl]-C-hydroxycarbonimidoyl}eth-1-en-1-yl)-2-methoxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
3-[[3-acetyloxy-2-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxypropoxy]-hydroxyphosphoryl]oxy-2-aminopropanoic acid
4-[5-chloro-7-(3,5-dihydroxyhexanoyloxy)-3-[(1E,3E,5E)-hepta-1,3,5-trienyl]-7-methyl-6,8-dioxoisoquinolin-2-yl]butanoic acid
(15e)-5,8,18,21-tetrahydroxy-6-isopropyl-20-[2-(methylsulfanyl)ethyl]-2-oxa-11,12-dithia-7,19,22-triazabicyclo[7.7.6]docosa-7,15,18,21-tetraen-3-one
(3s,6s,9r,13s,18as)-16-chloro-3,13-diethyl-1,4,7,11-tetrahydroxy-6-(hydroxymethyl)-9-phenyl-3h,6h,9h,10h,13h,18h,18ah-pyrrolo[1,2-d]1,4,7,10,13-pentaazacyclohexadecan-14-one
(2s)-2-{[(2r)-2-{[(4s)-4-amino-4-carboxy-1-hydroxybutylidene]amino}-3-{[cyano(1h-indol-3-yl)methyl]sulfanyl}-1-hydroxypropylidene]amino}pentanedioic acid
(9as,10r,13s,13as)-10,13,15,16-tetrahydroxy-8-methoxy-2-methyl-3-(sec-butyl)-6,7,9a,10,13,13a-hexahydro-9-oxa-2-azahexaphene-1,14-dione
(1s,2r,3r,3as,8as)-8a-(3,4-dimethoxyphenyl)-3,3a-dihydroxy-4,6-dimethoxy-n,n-dimethyl-1-phenyl-1h,2h,3h,8h-cyclopenta[a]indene-2-carboxamide
astin D
{"Ingredient_id": "HBIN017204","Ingredient_name": "astin D","Alias": "astin d","Ingredient_formula": "C25H32ClN5O6","Ingredient_Smile": "CCC(C(=O)NC(CO)C(=O)NC(CC(=O)NC(CC)C(=O)O)C1=CC=CC=C1)NC(=O)C2=CC=CN2","Ingredient_weight": "534","OB_score": "52.77764408","CAS_id": "153125-15-6","SymMap_id": "SMIT11507;SMIT14403","TCMID_id": "1932","TCMSP_id": "MOL010456","TCM_ID_id": "6548","PubChem_id": "NA","DrugBank_id": "NA"}