Exact Mass: 601.2859974
Exact Mass Matches: 601.2859974
Found 301 metabolites which its exact mass value is equals to given mass value 601.2859974
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Penitrem C
C37H44ClNO4 (601.2958693999999)
Gly-arg-gly-glu-ser-pro
Ala Trp Tyr Tyr
Ala Tyr Trp Tyr
Ala Tyr Tyr Trp
Glu Lys Tyr Tyr
Glu Gln Tyr Tyr
Glu Tyr Lys Tyr
Glu Tyr Gln Tyr
Glu Tyr Tyr Lys
Glu Tyr Tyr Gln
Phe His Ile Trp
Phe His Leu Trp
Phe His Trp Ile
Phe His Trp Leu
Phe Ile His Trp
Phe Ile Trp His
Phe Leu His Trp
Phe Leu Trp His
Phe Ser Trp Tyr
Phe Ser Tyr Trp
Phe Trp His Ile
Phe Trp His Leu
Phe Trp Ile His
Phe Trp Leu His
Phe Trp Ser Tyr
Phe Trp Tyr Ser
Phe Tyr Ser Trp
Phe Tyr Trp Ser
His Phe Ile Trp
His Phe Leu Trp
His Phe Trp Ile
His Phe Trp Leu
His Ile Phe Trp
His Ile Trp Phe
His Leu Phe Trp
His Leu Trp Phe
His Pro Trp Tyr
C31H35N7O6 (601.2648690000001)
His Pro Tyr Trp
C31H35N7O6 (601.2648690000001)
His Trp Phe Ile
His Trp Phe Leu
His Trp Ile Phe
His Trp Leu Phe
His Trp Pro Tyr
C31H35N7O6 (601.2648690000001)
His Trp Tyr Pro
C31H35N7O6 (601.2648690000001)
His Tyr Pro Trp
C31H35N7O6 (601.2648690000001)
His Tyr Trp Pro
C31H35N7O6 (601.2648690000001)
Ile Phe His Trp
Ile Phe Trp His
Ile His Phe Trp
Ile His Trp Phe
Ile Gln Arg Trp
Ile Gln Trp Arg
Ile Arg Gln Trp
Ile Arg Trp Gln
Ile Trp Phe His
Ile Trp His Phe
Ile Trp Gln Arg
Ile Trp Arg Gln
Lys Glu Tyr Tyr
Lys Tyr Glu Tyr
Lys Tyr Tyr Glu
Leu Phe His Trp
Leu Phe Trp His
Leu His Phe Trp
Leu His Trp Phe
Leu Gln Arg Trp
Leu Gln Trp Arg
Leu Arg Gln Trp
Leu Arg Trp Gln
Leu Trp Phe His
Leu Trp His Phe
Leu Trp Gln Arg
Leu Trp Arg Gln
Asn Pro Trp Trp
C31H35N7O6 (601.2648690000001)
Asn Trp Pro Trp
C31H35N7O6 (601.2648690000001)
Asn Trp Trp Pro
C31H35N7O6 (601.2648690000001)
Pro His Trp Tyr
C31H35N7O6 (601.2648690000001)
Pro His Tyr Trp
C31H35N7O6 (601.2648690000001)
Pro Asn Trp Trp
C31H35N7O6 (601.2648690000001)
Pro Trp His Tyr
C31H35N7O6 (601.2648690000001)
Pro Trp Asn Trp
C31H35N7O6 (601.2648690000001)
Pro Trp Trp Asn
C31H35N7O6 (601.2648690000001)
Pro Trp Tyr His
C31H35N7O6 (601.2648690000001)
Pro Tyr His Trp
C31H35N7O6 (601.2648690000001)
Pro Tyr Trp His
C31H35N7O6 (601.2648690000001)
Gln Glu Tyr Tyr
Gln Ile Arg Trp
Gln Ile Trp Arg
Gln Leu Arg Trp
Gln Leu Trp Arg
Gln Arg Ile Trp
Gln Arg Leu Trp
Gln Arg Trp Ile
Gln Arg Trp Leu
Gln Trp Ile Arg
Gln Trp Leu Arg
Gln Trp Arg Ile
Gln Trp Arg Leu
Gln Tyr Glu Tyr
Gln Tyr Tyr Glu
Arg Ile Gln Trp
Arg Ile Trp Gln
Arg Leu Gln Trp
Arg Leu Trp Gln
Arg Gln Ile Trp
Arg Gln Leu Trp
Arg Gln Trp Ile
Arg Gln Trp Leu
Arg Thr Tyr Tyr
Arg Trp Ile Gln
Arg Trp Leu Gln
Arg Trp Gln Ile
Arg Trp Gln Leu
Arg Tyr Thr Tyr
Arg Tyr Tyr Thr
Ser Phe Trp Tyr
Ser Phe Tyr Trp
Ser Trp Phe Tyr
Ser Trp Tyr Phe
Ser Tyr Phe Trp
Ser Tyr Trp Phe
Thr Arg Tyr Tyr
Thr Tyr Arg Tyr
Thr Tyr Tyr Arg
Trp Ala Tyr Tyr
Trp Phe His Ile
Trp Phe His Leu
Trp Phe Ile His
Trp Phe Leu His
Trp Phe Ser Tyr
Trp Phe Tyr Ser
Trp His Phe Ile
Trp His Phe Leu
Trp His Ile Phe
Trp His Leu Phe
Trp His Pro Tyr
C31H35N7O6 (601.2648690000001)
Trp His Tyr Pro
C31H35N7O6 (601.2648690000001)
Trp Ile Phe His
Trp Ile His Phe
Trp Ile Gln Arg
Trp Ile Arg Gln
Trp Leu Phe His
Trp Leu His Phe
Trp Leu Gln Arg
Trp Leu Arg Gln
Trp Asn Pro Trp
C31H35N7O6 (601.2648690000001)
Trp Asn Trp Pro
C31H35N7O6 (601.2648690000001)
Trp Pro His Tyr
C31H35N7O6 (601.2648690000001)
Trp Pro Asn Trp
C31H35N7O6 (601.2648690000001)
Trp Pro Trp Asn
C31H35N7O6 (601.2648690000001)
Trp Pro Tyr His
C31H35N7O6 (601.2648690000001)
Trp Gln Ile Arg
Trp Gln Leu Arg
Trp Gln Arg Ile
Trp Gln Arg Leu
Trp Arg Ile Gln
Trp Arg Leu Gln
Trp Arg Gln Ile
Trp Arg Gln Leu
Trp Ser Phe Tyr
Trp Ser Tyr Phe
Trp Trp Asn Pro
C31H35N7O6 (601.2648690000001)
Trp Trp Pro Asn
C31H35N7O6 (601.2648690000001)
Trp Tyr Ala Tyr
Trp Tyr Phe Ser
Trp Tyr His Pro
C31H35N7O6 (601.2648690000001)
Trp Tyr Pro His
C31H35N7O6 (601.2648690000001)
Trp Tyr Ser Phe
Trp Tyr Tyr Ala
Tyr Ala Trp Tyr
Tyr Ala Tyr Trp
Tyr Glu Lys Tyr
Tyr Glu Gln Tyr
Tyr Glu Tyr Lys
Tyr Glu Tyr Gln
Tyr Phe Ser Trp
Tyr Phe Trp Ser
Tyr His Pro Trp
C31H35N7O6 (601.2648690000001)
Tyr His Trp Pro
C31H35N7O6 (601.2648690000001)
Tyr Lys Glu Tyr
Tyr Lys Tyr Glu
Tyr Pro His Trp
C31H35N7O6 (601.2648690000001)
Tyr Pro Trp His
C31H35N7O6 (601.2648690000001)
Tyr Gln Glu Tyr
Tyr Gln Tyr Glu
Tyr Arg Thr Tyr
Tyr Arg Tyr Thr
Tyr Ser Phe Trp
Tyr Ser Trp Phe
Tyr Thr Arg Tyr
Tyr Thr Tyr Arg
Tyr Trp Ala Tyr
Tyr Trp Phe Ser
Tyr Trp His Pro
C31H35N7O6 (601.2648690000001)
Tyr Trp Pro His
C31H35N7O6 (601.2648690000001)
Tyr Trp Ser Phe
Tyr Trp Tyr Ala
Tyr Tyr Ala Trp
Tyr Tyr Glu Lys
Tyr Tyr Glu Gln
Tyr Tyr Lys Glu
Tyr Tyr Gln Glu
Tyr Tyr Arg Thr
Tyr Tyr Thr Arg
Tyr Tyr Trp Ala
H-Gly-Arg-Ala-Asp-Ser-Pro-OH trifluoroacetate salt
H-Gly-Arg-Ala-Asp-Ser-Pro-OH (GRADSP) is a negative control peptide of GRGDdSP[1].
Rocacetrapib
C31H34F7NO3 (601.2426777999999)
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent CKD-519 is a selective and potent cholesteryl ester transfer protein (CETP) inhibitor, which inhibits CETP-mediated transfer of cholesteryl ester in human serum with an IC50 of 2.3 nM[1].
[N-[N-(4-Methoxy-2,3,6-trimethylphenylsulfonyl)-L-aspartyl]-D-(4-amidino-phenylalanyl)]-piperidine
Neojiangyouaconitine
A diterpene alkaloid with formula C33H47NO9, originally isolated from Aconitum carmichaeli.
(4S,4aS,5aR,11aS,12aR)-9-[[2-(tert-butylamino)acetyl]amino]-4,7-bis(dimethylamino)-1,10,11a,12a-tetrahydroxy-3,11,12-trioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide
N-[(3S,9R,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide
1-[[(2S,3R)-10-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
1-[[(2S,3S)-10-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
N-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(5S,6R,9R)-8-[(2,5-difluorophenyl)methyl]-5-methoxy-3,6,9-trimethyl-2-oxo-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-methylbenzenesulfonamide
1-[[(2R,3S)-10-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
3-cyclohexyl-1-[[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
1-[[(2R,3R)-10-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
3-cyclohexyl-1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
3-cyclohexyl-1-[[(2R,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
1-[[(2S,3R)-10-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methyl-3-(1-naphthalenyl)urea
3-cyclohexyl-1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-8-[[(1-naphthalenylamino)-oxomethyl]amino]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-2-yl]methyl]-1-methylurea
N-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide
N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenoxyphenyl)methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-4-oxanecarboxamide
N-[(3S,9R,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclohexanecarboxamide
N-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-2-[[(4-methoxyphenyl)sulfonyl-methylamino]methyl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]cyclohexanecarboxamide
N-[(3R,9R,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3S,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3R,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3R,9S,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3S,9S,10S)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
2-amino-3-[hydroxy-[2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxy-3-pentanoyloxypropoxy]phosphoryl]oxypropanoic acid
C29H48NO10P (601.3015677999999)
2-amino-3-[[3-heptanoyloxy-2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
C29H48NO10P (601.3015677999999)
2-amino-3-[hydroxy-[2-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]oxy-3-propanoyloxypropoxy]phosphoryl]oxypropanoic acid
C29H48NO10P (601.3015677999999)
(2s)-3-{[(4s,5s)-4-({[(3s)-2-[(2r)-3-(dihydroxycarbonimidoyl)-2-pentylpropanoyl]-1,2-diazinan-3-yl](hydroxy)methylidene}amino)-5-methyl-3-oxoheptyl]sulfanyl}-2-[(1-hydroxyethylidene)amino]propanoic acid
C27H47N5O8S (601.3145182000001)
11-ethyl-5,8-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate
4-methylaconitane-1,6,8,13,14,15,16,18-octol; (1α,6α,14α,15α,16β)-form,o6,o16,o18,n-tetra-me,14-benzoyl,8-ac
C32H43NO10 (601.2886818000001)
{"Ingredient_id": "HBIN010682","Ingredient_name": "4-methylaconitane-1,6,8,13,14,15,16,18-octol; (1\u03b1,6\u03b1,14\u03b1,15\u03b1,16\u03b2)-form,o6,o16,o18,n-tetra-me,14-benzoyl,8-ac","Alias": "NA","Ingredient_formula": "C32H43NO10","Ingredient_Smile": "NA","Ingredient_weight": "601.68","OB_score": "NA","CAS_id": "110081-95-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7778","PubChem_id": "NA","DrugBank_id": "NA"}
8-deacetylsungpanconitine
{"Ingredient_id": "HBIN013692","Ingredient_name": "8-deacetylsungpanconitine","Alias": "NA","Ingredient_formula": "C33H47NO9","Ingredient_Smile": "CCN1CC2(C(CC(C34C2C(C(C31)C5(CC(C6CC4C5C6OC(=O)C7=CC=C(C=C7)OC)OC)O)OC)OC)O)COC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4773","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,2r,5s,8r,9r,11s,14r,15s,24s,26s,27s)-20-chloro-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol
C37H44ClNO4 (601.2958693999999)
15-(6-amino-2-hydroxy-3-methyl-5,8-dioxonaphthalen-1-yl)-5,7,9,11-tetrahydroxy-4,6,8,10,12,14-hexamethyl-15-oxopentadeca-2,13-dienoic acid
C32H43NO10 (601.2886818000001)
(2r)-3-({4-[({2-[3-(dihydroxycarbonimidoyl)-2-pentylpropanoyl]-1,2-diazinan-3-yl}(hydroxy)methylidene)amino]-5-methyl-3-oxoheptyl}sulfanyl)-2-[(1-hydroxyethylidene)amino]propanoic acid
C27H47N5O8S (601.3145182000001)
(2e,4r,5s,6s,7s,8s,9r,10r,11r,12s,13e)-15-(6-amino-2-hydroxy-3-methyl-5,8-dioxonaphthalen-1-yl)-5,7,9,11-tetrahydroxy-4,6,8,10,12,14-hexamethyl-15-oxopentadeca-2,13-dienoic acid
C32H43NO10 (601.2886818000001)
20-chloro-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol
C37H44ClNO4 (601.2958693999999)
(1s,2r,3r,4r,5s,6s,8r,9r,10r,13s,16s,17r,18r)-11-ethyl-5,8-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate
(1s,2r,5s,8r,9r,11r,14r,15s,24s,26s,27s)-20-chloro-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol
C37H44ClNO4 (601.2958693999999)
(1s,2r,5s,8r,9s,11r,14s,15r,24r,26s,27s)-20-chloro-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol
C37H44ClNO4 (601.2958693999999)