Exact Mass: 678.1585
Exact Mass Matches: 678.1585
Found 17 metabolites which its exact mass value is equals to given mass value 678.1585,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
3,4,5-Tricaffeoylquinic acid
1,3,5-tricaffeoylquinic acid
TCQA cpd
(3R,5R)-3,4,5-tris{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1-hydroxycyclohexane-1-carboxylic acid is an alkyl caffeate ester and a quinic acid.
(3R,5R)-3,4,5-tris[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1-hydroxycyclohexane-1-carboxylic acid
(1s,3r,4r,5r)-1,3,4-tris({[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})-5-hydroxycyclohexane-1-carboxylic acid
1,3,5-tri-o-caffeoylquinic acid
{"Ingredient_id": "HBIN001076","Ingredient_name": "1,3,5-tri-o-caffeoylquinic acid","Alias": "1,3,5-tri-O-caffeoylquinic acid; 1,3,5-tri-o-caffeoyl quinicacid","Ingredient_formula": "C34H30O15","Ingredient_Smile": "C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)OC(=O)C=CC4=CC(=C(C=C4)O)O","Ingredient_weight": "678.6 g/mol","OB_score": "3.009449084","CAS_id": "NA","SymMap_id": "SMIT12546","TCMID_id": "21536;41086","TCMSP_id": "MOL011675","TCM_ID_id": "NA","PubChem_id": "10190081","DrugBank_id": "NA"}
