Exact Mass: 642.1585
Exact Mass Matches: 642.1585
Found 108 metabolites which its exact mass value is equals to given mass value 642.1585
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Myricetin 3,3'-digalactoside
Myricetin 3,3-digalactoside is found in herbs and spices. Myricetin 3,3-digalactoside is isolated from Myrica gale (bog myrtle). Isolated from Myrica gale (bog myrtle). Myricetin 3,3-digalactoside is found in herbs and spices.
3-Rhamnosyl-Glucosyl Quercetin
Complanatoside A
Quercetagetin 7-(6-(E)-caffeoylglucoside)
Brartemicin
A glycosyl glycoside derivative that consists of alpha,alpha-trehalose substituted at positions 6 and 6 by O-2,4-dihydroxy-6-methylbenzoyl groups. It is isolated from the culture broth of actinomycete, Nonomuraea, and has antitumor activity.
7-hydroxy-2,3,4,5-tetramethoxy-1-O-primeverosyloxyxanthone
myricetin 7-O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside
(-)-10-C-(beta-D-Xylopyranosyl)-1,1,8,8,10,10-hexahydroxy-3,3-dimethyl-10,7-bianthracene-9,9-dione|(-)-10-C--1,1,8,8,10,10-hexahydroxy-3,3-dimethyl-10,7-bianthracene-9,9-dione
CxpCp|O2-methyl-cytidylyl-(3->5)-[3]cytidylic acid
3-Methoxy-4-chloro-5-(2-(2,5-dihydroxy-3-(3-methyl-2-butenyl)-3,4-epoxycyclohexane-1-ylidene)ethenyl)-5,7-dimethyl-5-hydroxy-4,8-dioxospiro[bicyclo[2.2.2]octane-7,2-[4H][1,3]benzodioxin]-2-ene-1-carboxylic acid methyl ester
1-O-[beta?D-xylopyranosyl-(1?6)-beta?D-glucopyranosyl]-8-hydroxy-2,3,4,5-tetramethoxyxanthone
quercetagetin-6-O-(6-O-caffeoyl-beta-D-glucopyranoside)
8-O-[beta?D-xylopyranosyl-(1?6)-beta?D-glucopyranosyl]-1-hydroxy-2,3,4,5-tetramethoxyxanthone
(1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-4-oxo-4H-1-benzopyran-8-yl]-2-O-[(4-hydroxy-3.5-dimethoxyphenyl)carbonyl]-D-glucitol|hispidulin 8-C-(2-O-syringoyl-beta-D-glucopyranoside)
4,5,5,7-tetrahydroxyflavon-2,6-di-O-beta-glucoside|artemisidin A
8-[5-(5-Hydroxy-2,3-dihydro-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)-2,3-dimethoxyphenyl]-5-hydroxy-2,3-dihydro-7-methoxy-2-(1,3-benzodioxole-5-yl)-4H-1-benzopyran-4-one
8-{7-[(6-deoxy-alpha-D-galactopyranosyl)oxy]-2-oxo-2H-chromen-8-yl}-7-methoxy-3-[(2-oxo-2H-chromen-7-yl)oxy]-2H-chromen-2-one
ComplanatosideA
Complanatoside A is a natural product found in Picea abies with data available.
4-[3-(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-12-hydroxy-7-methyl-6-oxonaphtho[1,2-c]isochromene-10-carboxylic acid
AVE6324
CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4359; ORIGINAL_PRECURSOR_SCAN_NO 4358 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4389; ORIGINAL_PRECURSOR_SCAN_NO 4386 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4382; ORIGINAL_PRECURSOR_SCAN_NO 4380 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4381; ORIGINAL_PRECURSOR_SCAN_NO 4379 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4387; ORIGINAL_PRECURSOR_SCAN_NO 4386 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4387; ORIGINAL_PRECURSOR_SCAN_NO 4384 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8993; ORIGINAL_PRECURSOR_SCAN_NO 8991 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8995; ORIGINAL_PRECURSOR_SCAN_NO 8993 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9013; ORIGINAL_PRECURSOR_SCAN_NO 9012 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9032; ORIGINAL_PRECURSOR_SCAN_NO 9031 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9027; ORIGINAL_PRECURSOR_SCAN_NO 9025 CONFIDENCE standard compound; INTERNAL_ID 1219; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9037; ORIGINAL_PRECURSOR_SCAN_NO 9034
Benzoylpas calcium
C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent
(1R)-1-[(ethoxycarbonyl)oxy]ethyl 1-{[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl]methyl}-2-{[1-(propan-2-yl)piperidin-4-yl]carbamoyl}-1H-indole-5-carboxylate
[1-(2-amino-7-methyl-4-oxo-7,8-dihydro-3H-pteridin-6-yl)]ethyl-(4-aminophenyl)-1-deoxy-5-[1-alpha-D-ribofuranosyl 5-phosphate]-D-ribitol
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-6-[2,3,4,5-tetrahydroxy-6-(hydroxymethyl)-3-(2,3,4,5-tetrahydroxy-6-methyloxan-3-yl)oxan-2-yl]chromen-4-one
5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
6-({4,5-Dihydroxy-2-[hydroxy({2,3,4-trihydroxy-6-oxo-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl})methyl]oxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
4-[3-(3,5-Dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-12-hydroxy-7-methyl-6-oxonaphtho[1,2-c]isochromene-10-carboxylic acid
2-(3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-5,7-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one
EB-3D
EB-3D is a potent and selective choline kinase α (ChoKα) inhibitor, with an IC50 of 1 μM for ChoKα1. EB-3D exerts effects on ChoKα expression, AMPK activation, apoptosis, endoplasmic reticulum stress and lipid metabolism. EB-3D exhibits a potent antiproliferative activity in a panel of T-leukemia cell lines. Anti-cancer activity[1][2][3].
methyl (1s,3s,6r,7s)-7-chloro-4-[(1r,2r,5s,6s)-2-(2,6-dihydroxy-4-methylbenzoyloxy)-5-hydroxy-1-(3-methylbut-2-en-1-yl)-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-3-hydroxy-8-methoxy-6-methyl-2-oxotricyclo[4.3.1.0³,⁷]deca-4,8-diene-1-carboxylate
2-(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-5,7-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
5-hydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-{[(2s,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)chromen-4-one
7-methoxy-3-[(2-oxochromen-7-yl)oxy]-7'-{[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-[8,8'-bichromene]-2,2'-dione
(2r,4'ar,8'as)-3'-chloro-5'-[(1r,2r,3e,5s,6s)-2,5-dihydroxy-1-(3-methylbut-2-en-1-yl)-7-oxabicyclo[4.1.0]heptan-3-ylidene]-5-hydroxy-8'a-(2-hydroxyacetyl)-4'-methoxy-7,7'-dimethyl-4'a,8'-dihydrospiro[1,3-benzodioxine-2,1'-naphthalene]-2',4-dione
2,14,16,17-tetrakis(acetyloxy)-8-chloro-3-hydroxy-4,13,17-trimethyl-9-methylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadec-10-en-12-yl acetate
2-(2-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}prop-1-en-1-yl)-3-(1-hydroxyethenyl)-6-(3,4,5-trihydroxyphenyl)pyran-4-one
(9's,10r)-1,4',5',8,9',10-hexahydroxy-2',6-dimethyl-10-[(2r,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]-[2,9'-bianthracene]-9,10'-dione
methyl 18'-chloro-5,8'-dihydroxy-17'-methoxy-7,13'-dimethyl-5'-(3-methylbut-2-en-1-yl)-4-oxo-2',3',6'-trioxaspiro[1,3-benzodioxine-2,19'-hexacyclo[13.3.1.0¹,¹¹.0⁴,¹⁰.0⁵,⁷.0¹³,¹⁸]nonadecane]-9',11'-diene-15'-carboxylate
2-(3,5-dihydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-5,7-dihydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
4,5,4',5'-tetrahydroxy-1:1'-binaphthyl
{"Ingredient_id": "HBIN009973","Ingredient_name": "4,5,4',5'-tetrahydroxy-1:1'-binaphthyl","Alias": "NA","Ingredient_formula": "C38H26O10","Ingredient_Smile": "CC1=C(C2=C(C(=O)C(=O)C=C2C(=C1C3=C(C4=CC(=O)C(=O)C(=C4C(=C3C)O)C(=O)CC5=CC=CC=C5)O)O)C(=O)CC6=CC=CC=C6)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21067","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6''-o-p-hydroxybenzoyliridin
{"Ingredient_id": "HBIN012713","Ingredient_name": "6''-o-p-hydroxybenzoyliridin","Alias": "NA","Ingredient_formula": "C31H30O15","Ingredient_Smile": "COC1=CC(=CC(=C1OC)O)C2=COC3=CC(=C(C(=C3C2=O)O)OC)OC4C(C(C(C(O4)COC(=O)C5=CC=C(C=C5)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15814","TCMID_id": "9825","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}