Exact Mass: 839.2769

Exact Mass Matches: 839.2769

Found 18 metabolites which its exact mass value is equals to given mass value 839.2769, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

S-Adenosylmethionine folate

5-{[(3-amino-3-carboxypropyl)({[5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl})methyl-lambda4-sulfanyl]oxy}-2-[(4-{[(2-amino-4-oxo-3,4-dihydropteridin-6-yl)methyl]amino}phenyl)formamido]-5-oxopentanoic acid

C34H41N13O11S (839.2769)

alatamine

O2-Benzoyl-O2-deacetyl-26-hydroxyevonimine

C41H45NO18 (839.2637)

20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

C41H45NO18 (839.2637)

(1s,3r,18s,19r,20r,21s,22s,24r,25r,26s)-20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

(1s,3r,18s,19r,20r,21s,22s,24r,25r,26s)-20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

C41H45NO18 (839.2637)

alatamine

CHEMBL503871

C41H45NO18 (839.2637)

{"Ingredient_id": "HBIN015040","Ingredient_name": "alatamine","Alias": "CHEMBL503871","Ingredient_formula": "C41H45NO18","Ingredient_Smile": "CC(=O)OCC12C(C(C3C(C14C(C(C(=O)C2OC(=O)C)C(O4)(COC(=O)C5=C(CCC(C(=O)O3)(C)O)N=CC=C5)C)OC(=O)C)(C)O)OC(=O)C6=CC=CC=C6)OC(=O)C","Ingredient_weight": "839.8 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT01790","TCMID_id": "23534","TCMSP_id": "NA","TCM_ID_id": "7066","PubChem_id": "131675972","DrugBank_id": "NA"}

11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-4'-[(2-methylbutanoyl)oxy]-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-5'-yl pyridine-3-carboxylate

11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-4'-[(2-methylbutanoyl)oxy]-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-5'-yl pyridine-3-carboxylate

C42H49NO17 (839.3)

(1's,2s,3'r,4'r,5's,7'r,8'r,10'r,11'r,12'r,13's,16's)-11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-5'-{[(2r)-2-methylbutanoyl]oxy}-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-4'-yl pyridine-3-carboxylate

(1's,2s,3'r,4'r,5's,7'r,8'r,10'r,11'r,12'r,13's,16's)-11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-5'-{[(2r)-2-methylbutanoyl]oxy}-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-4'-yl pyridine-3-carboxylate

C42H49NO17 (839.3)

(3r)-3-[(1s,4r,7s,14s,17s,20r,23s,31r)-26,27-dichloro-2,15,18,31-tetrahydroxy-7-isopropyl-17-(methoxymethyl)-4-(1-methylcyclopropyl)-5,8,21-trioxo-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.0⁹,¹⁴.0²³,³¹.0²⁵,³⁰]dotriaconta-2,15,18,25,27,29-hexaen-20-yl]-3-hydroxypropanoic acid

(3r)-3-[(1s,4r,7s,14s,17s,20r,23s,31r)-26,27-dichloro-2,15,18,31-tetrahydroxy-7-isopropyl-17-(methoxymethyl)-4-(1-methylcyclopropyl)-5,8,21-trioxo-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.0⁹,¹⁴.0²³,³¹.0²⁵,³⁰]dotriaconta-2,15,18,25,27,29-hexaen-20-yl]-3-hydroxypropanoic acid

C36H47Cl2N7O12 (839.266)

11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-5'-[(2-methylbutanoyl)oxy]-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-4'-yl pyridine-3-carboxylate

11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-5'-[(2-methylbutanoyl)oxy]-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-4'-yl pyridine-3-carboxylate

C42H49NO17 (839.3)

(3s)-3-[(1s,4r,7s,14s,17s,20r,23s,31r)-26,27-dichloro-2,15,18,31-tetrahydroxy-7-isopropyl-17-(methoxymethyl)-4-(1-methylcyclopropyl)-5,8,21-trioxo-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.0⁹,¹⁴.0²³,³¹.0²⁵,³⁰]dotriaconta-2,15,18,25,27,29-hexaen-20-yl]-3-hydroxypropanoic acid

(3s)-3-[(1s,4r,7s,14s,17s,20r,23s,31r)-26,27-dichloro-2,15,18,31-tetrahydroxy-7-isopropyl-17-(methoxymethyl)-4-(1-methylcyclopropyl)-5,8,21-trioxo-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.0⁹,¹⁴.0²³,³¹.0²⁵,³⁰]dotriaconta-2,15,18,25,27,29-hexaen-20-yl]-3-hydroxypropanoic acid

C36H47Cl2N7O12 (839.266)

(1r,3s,15r,18s,19r,20s,21r,22r,24s,25r,26r)-20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

(1r,3s,15r,18s,19r,20s,21r,22r,24s,25r,26r)-20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

C41H45NO18 (839.2637)

3-[26,27-dichloro-2,15,18,31-tetrahydroxy-7-isopropyl-17-(methoxymethyl)-4-(1-methylcyclopropyl)-5,8,21-trioxo-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.0⁹,¹⁴.0²³,³¹.0²⁵,³⁰]dotriaconta-2,15,18,25,27,29-hexaen-20-yl]-3-hydroxypropanoic acid

3-[26,27-dichloro-2,15,18,31-tetrahydroxy-7-isopropyl-17-(methoxymethyl)-4-(1-methylcyclopropyl)-5,8,21-trioxo-6-oxa-3,9,10,16,19,22,24-heptaazapentacyclo[20.10.0.0⁹,¹⁴.0²³,³¹.0²⁵,³⁰]dotriaconta-2,15,18,25,27,29-hexaen-20-yl]-3-hydroxypropanoic acid

C36H47Cl2N7O12 (839.266)

(1's,2s,3'r,4'r,5's,7's,8'r,10'r,11'r,12'r,13's,16's)-11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-4'-{[(2r)-2-methylbutanoyl]oxy}-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-5'-yl pyridine-3-carboxylate

(1's,2s,3'r,4'r,5's,7's,8'r,10'r,11'r,12'r,13's,16's)-11',16'-bis(acetyloxy)-13'-(furan-3-yl)-10'-hydroxy-7'-(2-methoxy-2-oxoethyl)-6',6',8',12'-tetramethyl-4'-{[(2r)-2-methylbutanoyl]oxy}-9',15'-dioxo-2',14'-dioxaspiro[oxirane-2,17'-tetracyclo[8.6.1.0¹,¹².0³,⁸]heptadecan]-5'-yl pyridine-3-carboxylate

C42H49NO17 (839.3)

(1s,3r,15r,18s,19r,20r,21s,22s,24r,25r,26s)-20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

(1s,3r,15r,18s,19r,20r,21s,22s,24r,25r,26s)-20,22,25-tris(acetyloxy)-21-[(acetyloxy)methyl]-15,26-dihydroxy-3,15,26-trimethyl-6,16,23-trioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.0¹,²¹.0³,²⁴.0⁷,¹²]hexacosa-7,9,11-trien-19-yl benzoate

C41H45NO18 (839.2637)