Exact Mass: 618.228
Exact Mass Matches: 618.228
Found 234 metabolites which its exact mass value is equals to given mass value 618.228
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Bryotoxin A
A bufadienolide glycoside that is 3,5,11,14-tetrahydroxy-12,19-dioxobufa-20,22-dienolide attached to a 3-O-acetyl-4,6-dideoxy-beta-D-arabino-hexopyranosyl residue at position 3 via a glycosidic linkage. D020011 - Protective Agents > D002316 - Cardiotonic Agents > D002301 - Cardiac Glycosides D020011 - Protective Agents > D002316 - Cardiotonic Agents > D002018 - Bufanolides
Simulanoquinoline
Simulanoquinoline is found in fruits. Simulanoquinoline is an alkaloid from root bark of Zanthoxylum simulans (Szechuan pepper).
Oxofangchirine
A bisbenzylisoquinoline alkaloid that is 1,2,3,4-tetradehydroberbaman which has been substituted by a methyl group at position 2, methoxy groups at positions 6, 6, 7, and 12, and an oxo group at the 15 position. Isolated from Stephania tetrandra.
3-Vinylbacteriochlorophyllide a; 3-Deacetyl-3-vinylbacteriochlorophyllide a
1,1-[[(1alpha,2alpha,3beta,4beta)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(3,4-5-trimethoxyphenyl)cyclobutane-1,3-diyl]dicarbonyl]bis[5,6-dihydropyridin-2(1H)-one]|piperarboresine
14beta-hydroxy-19beta-oxobufa-4,20,22-trienolide-16alpha-O-acetyl-3beta-O-beta-D-glucopyranoside|urginin B
1beta-isobutyryloxy-2beta,6alpha,15-triacetoxy-9alpha-benzoyloxy-4alpha-hydroxydihydro-beta-agarofuran
16beta-Acetoxy-5-beta-D-glucopyranosyloxy-14-hydroxy-19-oxo-5beta,14beta-bufa-3,20,22-trienolid|16beta-acetoxy-5-beta-D-glucopyranosyloxy-14-hydroxy-19-oxo-5beta,14beta-bufa-3,20,22-trienolide|scillicyanoside
Glu Glu Arg Trp
Glu Glu Trp Arg
Glu Arg Glu Trp
Glu Arg Trp Glu
Glu Trp Glu Arg
Glu Trp Arg Glu
His His Tyr Tyr
His Asn Trp Tyr
His Asn Tyr Trp
His Trp Asn Tyr
His Trp Tyr Asn
His Tyr His Tyr
His Tyr Asn Trp
His Tyr Trp Asn
His Tyr Tyr His
Met Pro Trp Trp
Met Trp Pro Trp
Met Trp Trp Pro
Asn His Trp Tyr
Asn His Tyr Trp
Asn Asn Trp Trp
Asn Trp His Tyr
Asn Trp Asn Trp
Asn Trp Trp Asn
Asn Trp Tyr His
Asn Tyr His Trp
Asn Tyr Trp His
Pro Met Trp Trp
Pro Trp Met Trp
Pro Trp Trp Met
Arg Glu Glu Trp
Arg Glu Trp Glu
Arg Trp Glu Glu
Trp Glu Glu Arg
Trp Glu Arg Glu
Trp His Asn Tyr
Trp His Tyr Asn
Trp Met Pro Trp
Trp Met Trp Pro
Trp Asn His Tyr
Trp Asn Asn Trp
Trp Asn Trp Asn
Trp Asn Tyr His
Trp Pro Met Trp
Trp Pro Trp Met
Trp Arg Glu Glu
Trp Trp Met Pro
Trp Trp Asn Asn
Trp Trp Pro Met
Trp Tyr His Asn
Trp Tyr Asn His
Tyr His His Tyr
Tyr His Asn Trp
Tyr His Trp Asn
Tyr His Tyr His
Tyr Asn His Trp
Tyr Asn Trp His
Tyr Trp His Asn
Tyr Trp Asn His
Tyr Tyr His His
Simulanoquinoline
[1,1:4,1:3,1:4,1-Quinquephenyl]-4,4-dicarboxaldehyde, 5-(4-formyl[1,1-biphenyl]-4-yl)- (9CI)
2-[(E)-2-{(3E)-2-Chloro-3-[(2Z)-2-(1,1,3-trimethyl-1,3-dihydro-2H -benzo[e]indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl}vinyl]-1,1 ,3-trimethyl-1H-benzo[e]indolium chloride
Selatogrel
C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent > C190801 - P2Y12 Inhibitor
Hybrid Between B and C Type Hemes (Protoporphyrin Ixcontaining Fe)
(31R)-8-ethyl-71,71-dihydroxy-12-methylbacteriochlorophyllide c
O-methyl-4-O-[2-O-methyl-alpha-L-fucopyranosyl-(1->3)-alpha-L-rhamnopyranosyl-(1->3)-2-O-methyl-alpha-L-rhamnopyranosyl]-hydroxybenzoate
3-[18-(2-Carboxylatoethyl)-7,12-diethyl-3,8,13,17-tetramethylporphyrin-21,23-diid-2-yl]propanoate;iron
6-O-Nicotinoyl-7-O-acetylscutebarbatine G, (rel)
A natural product found in Scutellaria barbata.
alpha-D-abequopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->3)-alpha-D-galactopyranose
alpha-D-abequopyranosyl-(1->3)-[alpha-D-galactopyranosyl-(1->2)]-alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranose
5,10,15,20-Tetrapyridin-4-yl-21,22-dihydroporphyrin
2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
2-[(1S,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
N-[(2S,4aS,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
3,6-dideoxy-alpha-D-arabino-hexopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->4)-6-deoxy-alpha-L-mannopyranosyl-(1->3)-alpha-D-galactopyranose
alpha-paratopyranosyl-(1->3)-alpha-D-mannopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->3)-alpha-D-galactopyranose
2-[(1S,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S)-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]urea
2-[(1R,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
2-[(1R,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
2-[(1R,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
N-[(2R,4aS,12aR)-2-[2-[[(3S)-1-benzylpyrrolidin-3-yl]amino]-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aR,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aR,12aR)-2-[2-[[(3R)-1-benzylpyrrolidin-3-yl]amino]-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
2-[(1R,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
N-[(2S,4aR,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aR,12aS)-2-[2-[[(3S)-1-benzylpyrrolidin-3-yl]amino]-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2S,4aR,12aS)-2-[2-[[(3R)-1-benzylpyrrolidin-3-yl]amino]-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2S,4aR,12aR)-2-[2-[[(3R)-1-benzylpyrrolidin-3-yl]amino]-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2S,4aS,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aS,12aS)-2-[2-[[(3S)-1-benzylpyrrolidin-3-yl]amino]-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aR,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2S,4aS,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
2-[(1S,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
N-[(2S,4aS,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2S,4aR,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aS,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
N-[(2R,4aS,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]amino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-3,4-difluorobenzamide
3,4,5-Trihydroxy-6-[2-(3-methylbut-2-enoyloxy)-2-[9-(3-methylbut-2-enoyloxy)-2-oxo-8,9-dihydrouro[2,3-h]chromen-8-yl]propoxy]oxane-2-carboxylic acid
biliverdin hydrochloride
A hydrochloride obtained by combining biliverdin with one molar equivalent of hydrogen chloride.
Biliverdin (hydrochloride)
Biliverdin hydrochloride is a tetrapyrrolic, water-soluble compound formed by the breakdown of heme. Biliverdin hydrochloride can upregulate the activity of biliverdin reductase which is an enzyme that is a regulator of the innate immune system[1].
6-(acetyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-[(2-methylbut-2-enoyl)oxy]-4-[(3-methylbut-2-enoyl)oxy]-2-oxo-4h,5h,6ah,7h,8h,9bh-azuleno[4,5-b]furan-7-yl 3-methylbut-2-enoate
(1ar,3s,3ar,4r,5r,6r,7as)-5-(formyloxy)-3-(furan-3-yl)-6-[(3r,4r)-3-(2-methoxy-2-oxoethyl)-2,2,4-trimethyl-7-oxo-3h-oxepin-4-yl]-3a-methyl-7-methylidene-hexahydroindeno[1,7a-b]oxiren-4-yl benzoate
9a-formyl-3a-hydroxy-11a-methyl-1-(6-oxopyran-3-yl)-5a-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,5h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-2-yl acetate
(1s,12s,13s,14s,15r)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-15-{[(2z)-2-methylbut-2-enoyl]oxy}-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-12-yl benzoate
(1r,2r,3s,4s,5r,6s,11s,12r,14r,16r,17r,18r,19r,20s,24r)-20-(furan-3-yl)-2,3,4,17-tetrahydroxy-5,14,19-trimethyl-8,22-dioxo-9,13,15,21,25-pentaoxaoctacyclo[12.10.1.1⁵,¹².0¹,¹⁶.0³,¹².0⁶,¹¹.0¹¹,¹⁶.0¹⁹,²⁴]hexacosan-18-yl acetate
20-(furan-3-yl)-2,3,4,17-tetrahydroxy-5,14,19-trimethyl-8,22-dioxo-9,13,15,21,25-pentaoxaoctacyclo[12.10.1.1⁵,¹².0¹,¹⁶.0³,¹².0⁶,¹¹.0¹¹,¹⁶.0¹⁹,²⁴]hexacosan-18-yl acetate
(1s,2r,4r,5r,7s,9s,10r,11s,12s,14s,15r,16s,17r,19s,22s,23r,24r)-14-(acetyloxy)-4,5,22-trihydroxy-11,15,17,22,23-pentamethyl-3,21,25-trioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacosan-10-yl acetate
(16r,17r,19r)-16-{[4,5-dihydroxy-5-(1-hydroxyethyl)-6-methyloxan-2-yl]oxy}-3,10-dihydroxy-17-methyl-4',5'-dihydro-1'h-18-oxaspiro[pentacyclo[15.2.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]icosane-19,2'-pyrrolo[2,3-b]pyrrole]-2,4(13),6,8,10,14-hexaene-5,12-dione
(1s,12s,13s,14s,15r)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-12-{[(2z)-2-methylbut-2-enoyl]oxy}-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4(21),5(9),10,16,18-pentaen-15-yl benzoate
5-[(2-{[(2-carboxyacetyl)oxy]methyl}-3,5-dihydroxy-6-({4-[2-(hydroxymethyl)-6,6-dimethyl-4-oxocyclohex-2-en-1-yl]butan-2-yl}oxy)oxan-4-yl)oxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
1,1',5,5',8,8',8a,8'a-octahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-5h,5'h,6h,6'h,7h,7'h,8h,8'h-[2,2'-bixanthene]-9,9'-dione
(1r,2s,3as,3br,5as,9as,9bs,11ar)-9a-formyl-3a-hydroxy-11a-methyl-1-(6-oxopyran-3-yl)-5a-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,5h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-2-yl acetate
1-deoxy-3-methacrylyl-11-methoxymeliacar-pinin
{"Ingredient_id": "HBIN002475","Ingredient_name": "1-deoxy-3-methacrylyl-11-methoxymeliacar-pinin","Alias": "NA","Ingredient_formula": "C32H42O12","Ingredient_Smile": "CC(=C)C(=O)OC1CCC23COC(C2C4(C(C5C3C1(CO5)C)OC6(C4(C7CC6C8(C=COC8O7)O)O)C)C)(C(=O)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5193","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-deoxy-3-methacrylyl-11-methoxymeliacarpnin
{"Ingredient_id": "HBIN002476","Ingredient_name": "1-deoxy-3-methacrylyl-11-methoxymeliacarpnin","Alias": "NA","Ingredient_formula": "C32H42O12","Ingredient_Smile": "NA","Ingredient_weight": "618.677","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9219","PubChem_id": "NA","DrugBank_id": "NA"}
4,7'-epoxy-3,8'-bilign-7-ene-3',4',5,9,9'-pentol; (7'r,8's)-form,3',5-di-me ether,9-o-[4-hydroxy-2-methylenebutanoyl-(→6)-beta-d-glucopyranoside]
{"Ingredient_id": "HBIN010121","Ingredient_name": "4,7'-epoxy-3,8'-bilign-7-ene-3',4',5,9,9'-pentol; (7'r,8's)-form,3',5-di-me ether,9-o-[4-hydroxy-2-methylenebutanoyl-(\u21926)-beta-d-glucopyranoside]","Alias": "NA","Ingredient_formula": "C31H38O13","Ingredient_Smile": "NA","Ingredient_weight": "618.63","OB_score": "NA","CAS_id": "166990-18-7","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7885","PubChem_id": "NA","DrugBank_id": "NA"}
Azadirachtin I
{"Ingredient_id": "HBIN017430","Ingredient_name": "Azadirachtin I","Alias": "NA","Ingredient_formula": "C32H42O12","Ingredient_Smile": "CC=C(C)C(=O)OC1CC(C2(COC3C2C14COC(C4C(C3O)(C)C56C7CC(C5(O6)C)C8(C=COC8O7)O)O)C)OC(=O)C","Ingredient_weight": "618.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32765","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "76309325","DrugBank_id": "NA"}