Exact Mass: 558.0016586
Exact Mass Matches: 558.0016586
Found 25 metabolites which its exact mass value is equals to given mass value 558.0016586,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
6-({5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxo-4H-chromen-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
(2S,3S,4S,5R)-6-[2-(3,4-Dihydroxyphenyl)-7-hydroxy-4-oxo-3-sulfooxychromen-5-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
hypolaetin 8-O-beta-D-glucuronopyranoside 3-O-sulfate|theograndin II
5-BroMo-4-chloro-3-indolyl-α-D-N-acetylneuraMinic acid sodiuM salt
C19H21BrClN2NaO9 (558.0016586)
Theograndin II
A glycosyloxyflavone and a monosaccharide sulfate that is the 8-O-beta-D-glucuronopyranoside-3-O-sulfate derivative of hypolaetin. It has been isolated from the seeds of Theobroma grandiflorum and has been shown to exhibit antioxidant activity.
6-[5,7-Dihydroxy-2-(4-hydroxy-3-sulooxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(6-oxo-1H-purin-9-yl)oxolan-2-yl]methoxy-oxidophosphoryl] [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl phosphate
C15H20N4O15P2-2 (558.0400390000001)
(2S,3S,4S,5R)-6-[2-(3,4-Dihydroxyphenyl)-7-hydroxy-4-oxo-3-sulfooxychromen-5-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
bazzanin n
C28H18Cl4O4 (557.9959147999999)
{"Ingredient_id": "HBIN017645","Ingredient_name": "bazzanin n","Alias": "NA","Ingredient_formula": "C28H18Cl4O4","Ingredient_Smile": "C1CC2=C(C(=C(C=C2C3=C(C(=C(C=CC4=CC(=C(C=C4)O)C5=C(C(=CC1=C5)Cl)O)C=C3)Cl)O)Cl)O)Cl","Ingredient_weight": "560.2 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2182","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101263413","DrugBank_id": "NA"}
(20e)-6,17,21,26-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(24),2,4,6,10,12,14(28),15(27),16,18,20,22,25-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)
(20e)-4,6,12,23-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)
4,17,21,23-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)
(2s,3s,4r,5r,6s)-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-(sulfooxy)chromen-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
(20z)-6,17,21,26-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(24),2,4,6,10,12,14(28),15(27),16,18,20,22,25-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)
(2s,3s,6s)-6-({5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4-oxochromen-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
6,17,21,26-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(24),2,4,6,10,12,14(28),15(27),16,18,20,22,25-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)
6-{[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-8-yl]oxy}-3,5-dihydroxy-4-(sulfooxy)oxane-2-carboxylic acid
(20e)-4,17,21,23-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)
(20z)-4,17,21,23-tetrachloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,20,22(26),23-tridecaene-5,13,16,24-tetrol
C28H18Cl4O4 (557.9959147999999)