Exact Mass: 802.1272
Exact Mass Matches: 802.1272
Found 48 metabolites which its exact mass value is equals to given mass value 802.1272,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Atractyloside
D004791 - Enzyme Inhibitors Atractyloside (potassium salt) is a member of pyridines. A glycoside of a kaurene type diterpene that is found in some plants including Atractylis gummifera (ATRACTYLIS); COFFEE; XANTHIUM, and CALLILEPIS. Toxicity is due to inhibition of ADENINE NUCLEOTIDE TRANSLOCASE. Atractyloside potassium salt is a toxic diterpenoid glycoside that can be isolated from the fruits of Xanthium sibiricum. Atractyloside potassium salt is a powerful and specific inhibitor of mitochondrial ADP/ATP transport. Atractyloside potassium salt inhibits chloride channels from mitochondrial membranes of rat heart[1][2][3]. Atractyloside potassium salt is a toxic diterpenoid glycoside that can be isolated from the fruits of Xanthium sibiricum. Atractyloside potassium salt is a powerful and specific inhibitor of mitochondrial ADP/ATP transport. Atractyloside potassium salt inhibits chloride channels from mitochondrial membranes of rat heart[1][2][3].
Punigluconin
Punigluconin is found in fruits. Punigluconin is a major tannin isolated from the bark of Punica granatum (pomegranate).
Sanguiin H7
Isolated from the underground parts of Sanguisorba officinalis (burnet bloodwort). Sanguiin H7 is found in alcoholic beverages and herbs and spices. Sanguiin H7 is found in alcoholic beverages. Sanguiin H7 is isolated from the underground parts of Sanguisorba officinalis (burnet bloodwort).
Vitilagin
Constituent of the leaves of Vitis vinifera (wine grape). Vitilagin is found in alcoholic beverages, fruits, and common grape. Vitilagin is found in alcoholic beverages. Vitilagin is a constituent of the leaves of Vitis vinifera (wine grape).
Methyl 2,3,4,6-tetra-O-galloyl-beta-D-glucopyranoside
Gallotannin constituent of Sanguisorba officinalis (burnet bloodwort). Methyl 2,3,4,6-tetra-O-galloyl-beta-D-glucopyranoside is found in tea and herbs and spices. Methyl 2,3,4,6-tetra-O-galloyl-beta-D-glucopyranoside is found in herbs and spices. Gallotannin constituent of Sanguisorba officinalis (burnet bloodwort).
Punigluconin
1-O-galloyl-4,6-(S)-tergalloyl-beta-D-glucose|carlesiin A
hexahydroxy-[2-hydroxy-1,3-bis[(3,4,5-trihydroxybenzoyl)oxy]propyl]-dioxo-[?]carboxylic acid
Methyl 2,3,4,6-tetra-O-galloyl-b-D-glucopyranoside
Sanguiin H7
(2,2-Bipyridine)bis(2-phenylpyridinato)iridium(III) Hexafluorophosphate
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4S)-5-(7,8-dimethyl-2,4,5-trioxo-1H-benzo[g]pteridin-5-ium-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphate
2-{[(1s,19r,21s,22r,23r)-6,8,11,12,13,22,23-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyloxy)-2,17,20-trioxatetracyclo[17.3.1.0⁴,⁹.0¹⁰,¹⁵]tricosa-4(9),5,7,10,12,14-hexaen-7-yl]oxy}-3,4,5-trihydroxybenzoic acid
2-{[6,7,11,12,13,22,23-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyloxy)-2,17,20-trioxatetracyclo[17.3.1.0⁴,⁹.0¹⁰,¹⁵]tricosa-4(9),5,7,10,12,14-hexaen-8-yl]oxy}-3,4,5-trihydroxybenzoic acid
(1s,7r,9r,18r,19s,21r,22s)-7,8,8,12,13,22-hexahydroxy-3,6,16-trioxo-21-[(3,4,5-trihydroxybenzoyloxy)methyl]-2,17,20,23-tetraoxapentacyclo[16.3.1.1⁷,¹¹.0⁴,⁹.0¹⁰,¹⁵]tricosa-4,10,12,14-tetraen-19-yl 3,4,5-trihydroxybenzoate
2-{[(1r,19s,21r,22s,23r)-6,8,11,12,13,22,23-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyloxy)-2,17,20-trioxatetracyclo[17.3.1.0⁴,⁹.0¹⁰,¹⁵]tricosa-4(9),5,7,10,12,14-hexaen-7-yl]oxy}-3,4,5-trihydroxybenzoic acid
2,3,4,6-tetra-o-galloyl-d-glucopyranoside
{"Ingredient_id": "HBIN003860","Ingredient_name": "2,3,4,6-tetra-o-galloyl-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C35H30O22","Ingredient_Smile": "NA","Ingredient_weight": "802.6","OB_score": "3.013720692","CAS_id": "52704-75-3","SymMap_id": "SMIT08398","TCMID_id": "NA","TCMSP_id": "MOL006847","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
atractyloside
{"Ingredient_id": "HBIN017299","Ingredient_name": "atractyloside","Alias": "NA","Ingredient_formula": "C30H44K2O16S2","Ingredient_Smile": "CC(C)CC(=O)OC1C(C(C(OC1OC2CC(C3CCC45CC(CCC4C3(C2)C)C(=C)C5O)C(=O)O)CO)OS(=O)(=O)[O-])OS(=O)(=O)[O-].[K+].[K+]","Ingredient_weight": "803 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1972","TCMSP_id": "NA","TCM_ID_id": "10036;10037;10038;10039;10040;10041;10042;10141;10142;10961;14225;14227;16303;16304;16305;16306;16307;16308;16309;16376;16377;16378","PubChem_id": "118701294","DrugBank_id": "NA"}
