Exact Mass: 414.1712

Exact Mass Matches: 414.1712

Found 12 metabolites which its exact mass value is equals to given mass value 414.1712, within given mass tolerance error 4.0E-5 dalton. Try search metabolite list with more accurate mass tolerance error 8.0E-6 dalton.

   

14-Deoxyandrographolide-3-O-sulfate

14-Deoxyandrographolide-3-O-sulfate

C20H30O7S (414.1712)


   

2-[(1S,2R,5S,9R,12S,16R)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-5-yl]ethyl hydrogen sulfate

2-[(1S,2R,5S,9R,12S,16R)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.02,7.012,16]hexadec-7-en-5-yl]ethyl hydrogen sulfate

C20H30O7S (414.1712)


   
   

14-deoxyandrographolide-3-o-sulfate

NA

C20H30O7S (414.1712)


{"Ingredient_id": "HBIN001415","Ingredient_name": "14-deoxyandrographolide-3-o-sulfate","Alias": "NA","Ingredient_formula": "C20H30O7S","Ingredient_Smile": "CC12CCC(C(C1CCC(=C)C2CCC3=CCOC3=O)(C)CO)OS(=O)(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5152","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-[(1s,2r,5s,9r,12s,16r)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-en-5-yl]ethoxysulfonic acid

2-[(1s,2r,5s,9r,12s,16r)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-en-5-yl]ethoxysulfonic acid

C20H30O7S (414.1712)


   

2-[(1r,2s,5r,9s,12r,16s)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-en-5-yl]ethoxysulfonic acid

2-[(1r,2s,5r,9s,12r,16s)-2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-en-5-yl]ethoxysulfonic acid

C20H30O7S (414.1712)


   

(2-isopropyl-6-methoxy-3,5-dimethyl-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)(methylsulfanyl)methanone

(2-isopropyl-6-methoxy-3,5-dimethyl-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)(methylsulfanyl)methanone

C20H30O7S (414.1712)


   

{2-isopropyl-4-methoxy-3,5-dimethyl-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}(methylsulfanyl)methanone

{2-isopropyl-4-methoxy-3,5-dimethyl-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}(methylsulfanyl)methanone

C20H30O7S (414.1712)


   

2-{2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-en-5-yl}ethoxysulfonic acid

2-{2-hydroxy-1,5,12-trimethyl-11-oxo-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-7-en-5-yl}ethoxysulfonic acid

C20H30O7S (414.1712)


   

(2-isopropyl-4-methoxy-3,5-dimethyl-6-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)(methylsulfanyl)methanone

(2-isopropyl-4-methoxy-3,5-dimethyl-6-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)(methylsulfanyl)methanone

C20H30O7S (414.1712)


   

{2-isopropyl-6-methoxy-3,5-dimethyl-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}(methylsulfanyl)methanone

{2-isopropyl-6-methoxy-3,5-dimethyl-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}(methylsulfanyl)methanone

C20H30O7S (414.1712)