Exact Mass: 494.0843
Exact Mass Matches: 494.0843
Found 291 metabolites which its exact mass value is equals to given mass value 494.0843
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Salvianolic acid A
Salvianolic acid A could protect the blood brain barrier through matrix metallopeptidase 9 (MMP-9) inhibition and anti-inflammation. Salvianolic acid A could protect the blood brain barrier through matrix metallopeptidase 9 (MMP-9) inhibition and anti-inflammation.
2-O-Galloylsucrose
2-O-Galloylsucrose is found in green vegetables. 2-O-Galloylsucrose is isolated from the commercial Chinese rhubarb (Rheum species). Isolated from the commercial Chinese rhubarb (Rheum subspecies). 2-O-Galloylsucrose is found in green vegetables.
Quercetagetin 3'-methylether 7-glucoside
Quercetagetin 3-methylether 7-glucoside is found in garland chrysanthemum. Quercetagetin 3-methylether 7-glucoside is isolated from Chrysanthemum coronarium (chop-suey greens). Isolated from Chrysanthemum coronarium (chop-suey greens). Quercetagetin 3-methylether 7-glucoside is found in garland chrysanthemum and herbs and spices.
6'-O-Galloylsucrose
6-O-Galloylsucrose is found in green vegetables. 6-O-Galloylsucrose is isolated from commercial Chinese rhubarb (Rheum species). Isolated from commercial Chinese rhubarb (Rheum subspecies). 6-O-Galloylsucrose is found in green vegetables.
6-O-Galloylsucrose
6-O-Galloylsucrose is found in green vegetables. 6-O-Galloylsucrose is isolated from commercial Chinese rhubarb (Rheum species). Isolated from commercial Chinese rhubarb (Rheum subspecies). 6-O-Galloylsucrose is found in green vegetables.
1'-O-Galloylsucrose
1-O-Galloylsucrose is found in green vegetables. 1-O-Galloylsucrose is a tannin isolated from commercial Chinese rhubarb (Rheum species). A tannin isolated from commercial Chinese rhubarb (Rheum subspecies). 1-O-Galloylsucrose is found in green vegetables.
6-{[2-(3,4-dihydroxyphenyl)-3,5,6-trihydroxy-4-oxo-4H-chromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
4'-O-Galloylsucrose
Tannin constituent of commercial Chinese rhubarb (Rheum subspecies). 4-O-Galloylsucrose is found in green vegetables. 4-O-Galloylsucrose is found in green vegetables. Tannin constituent of commercial Chinese rhubarb (Rheum species).
6-{[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
Phenolphthalein glucuronide
Salvianolic acid A
Belinostat glucuronide
Patuletin 7-glucoside
Patuletin 7-glucoside is a member of the class of compounds known as flavonoid-7-o-glycosides. Flavonoid-7-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Patuletin 7-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Patuletin 7-glucoside can be found in german camomile, which makes patuletin 7-glucoside a potential biomarker for the consumption of this food product.
Salvianolic
Salvianolic acid A is a stilbenoid. Salvianolic acid A is under investigation in clinical trial NCT03908242 (Phase I Study of Continuous Administration of Salvianolic Acid A Tablet). Salvianolic acid A is a natural product found in Salvia miltiorrhiza, Salvia flava, and other organisms with data available. D004791 - Enzyme Inhibitors > D054328 - Proton Pump Inhibitors D000970 - Antineoplastic Agents Salvianolic acid A could protect the blood brain barrier through matrix metallopeptidase 9 (MMP-9) inhibition and anti-inflammation. Salvianolic acid A could protect the blood brain barrier through matrix metallopeptidase 9 (MMP-9) inhibition and anti-inflammation.
3,5,7,3,4-Pentahydroxy-6,8-dimethoxyflavone 3-alpha-L-arabinopyranoside
Quercetagetin 7-methyl ether 4-glucoside
Hibifolin
Hibifolin is a natural product found in Helicteres isora, Abelmoschus manihot, and Sedum album with data available. Hibifolin, a flavonol glycoside, is a potential inhibitor of adenosine deaminase (ADA), with a Ki of 49.92 μM. Hibifolin protects neurons against beta-amyloid-induced neurotoxicity[1][2]. Hibifolin, a flavonol glycoside, is a potential inhibitor of adenosine deaminase (ADA), with a Ki of 49.92 μM. Hibifolin protects neurons against beta-amyloid-induced neurotoxicity[1][2].
Myricetin 4-methyl ether 3-O-beta-D-galactopyranoside
Quercetagetin 7-methyl ether 6-glucoside
Quercetagetin 7-methyl ether 3-glucoside
Hibiscetin 8-methyl ether 3-rhamnoside
1-Galloyl-beta-D-glucopyranosyl-(1-4)-beta-D-galactopyranoside
1S-hydroperoxy-12S-hydroxy-bromosphaerol-B|1S-hydroperoxy-12S-hydroxybromosphaerol-B
1-Galloyl-??-D-glucopyranosyl-(1鈥樏傗垎4)-??-D-galactopyranoside
3-O-(E)-caffeoyl-4-O-galloyl-D-glucopyranose|3-O-(E)-Caffeoyl-4-O-galloyl-??-D-glucopyranose
3,5-Di-Me ether,tri-Ac-3,4,4,5,5-Pentahydroxy-2,7-cycloligna-7,7-dien-9,9-olide
Me glycoside,4,6-dibenzoyl,2-mesyl-3-O-Methylgalactose
beta-D-glucopyranosyl-(6->1)-beta-D-glucopyranosyl 3,4,5-trihydroxybenzoate
1-O-(E)-caffeoyl-3-galloyl-beta-D-glucopyranose|1-O-(E)-caffeoyl-3-O-galloyl-beta-D-glucopyranose|1-O-(E)-Caffeoyl-3-O-galloyl-??-D-glucopyranose
1-O-caffeoyl-6-O-galloyl-beta-D-glucopyranose|1-O-(E)-caffeoyl-6-O-galloyl-beta-D-glucopyranose
3,3-dimethoxy-4-O-beta-D-xylopyranosylellagic acid
11-O-(3-O-methylgalloyl)-bergenin|11-O-(3-O-methylgalloyl)bergenin
12,13-dihydro-3,4,5,7-tetrahydroxy-12-hydroxymethyl-13-(17-hydroxyl-16,18-dimethoxyphenyl)-7H-benzo[c]xanthen-4-one|falloconvolin B
3,4,5,6,8,13-Hexahydro-2-methyl-8,13-dioxo-2,6-epoxy-2H-anthra[2,3-b]oxocin-7,9,11-triyl=triacetate
5-O-beta-D-glucopyranosyl-6-[(1E,3E)-6-hydroxy-1,3-hexadienyl]-2-hydroxymethyl-thieno[2,3-e]isobenzofuran-8(6H)-one|echinothiophene
Laricitrin 3-O-glucoside
Laricitrin 3-O-glucoside is a natural product found in Vitis vinifera and Picea abies with data available.
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-8-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
2-(3,5-dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Cys Asp Glu Glu
Cys Glu Asp Glu
Cys Glu Glu Asp
Asp Cys Glu Glu
Asp Asp Asp Met
Asp Asp Met Asp
Asp Glu Cys Glu
Asp Glu Glu Cys
Asp Met Asp Asp
Glu Cys Asp Glu
Glu Cys Glu Asp
Glu Asp Cys Glu
Glu Asp Glu Cys
Glu Glu Cys Asp
Glu Glu Asp Cys
Met Asp Asp Asp
Quercetagetin 3'-methylether 7-glucoside
2-O-Galloylsucrose
6-O-Galloylsucrose
1'-O-Galloylsucrose
4'-O-Galloylsucrose
6'-O-Galloylsucrose
[2-[(8S,9R,10S,13S,14S,17R)-9-bromo-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
DICHLOROBIS[2-(DI-I-PROPYLPHOSPHINO)ETHYLAMINE]RUTHENIUM (II), MIN
N-[2-[(2-chloro-4,6-dinitrophenyl)azo]-5-(ethylamino)-4-(2-methoxyethoxy)phenyl]propionamide
1-[5-methyl-2-(trifluoromethyl)furan-3-yl]-3-[(2Z)-5-(2-{[6-(1H-1,2,4-triazol-3-ylamino)pyrimidin-4-yl]amino}ethyl)-1,3-thiazol-2(3H)-ylidene]urea
1-[[2-[[4-(4-Chlorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-3-phenylthiourea
2,6-Dichloro-4-(2-Piperazin-1-Ylpyridin-4-Yl)-N-(1,3,5-Trimethyl-1h-Pyrazol-4-Yl)benzenesulfonamide
96574-01-5
D004791 - Enzyme Inhibitors > D054328 - Proton Pump Inhibitors D000970 - Antineoplastic Agents Salvianolic acid A could protect the blood brain barrier through matrix metallopeptidase 9 (MMP-9) inhibition and anti-inflammation. Salvianolic acid A could protect the blood brain barrier through matrix metallopeptidase 9 (MMP-9) inhibition and anti-inflammation.
Patulitrin
N-(5-chloropyrimidin-2-yl)-7-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]quinolin-4-amine
Myricetin 3-O-glucuronide
A myricetin O-glucuronide that is myricetin with a beta-D-glucosiduronic acid residue attached at the 3-position.
3,4,5-trihydroxy-6-[[(E)-3-[3-(phenylsulfamoyl)phenyl]prop-2-enoyl]amino]oxyoxane-2-carboxylic acid
3-L-phenylalanyl-AMP
An L-phenylalanine derivative that is the ester obtained by formal condensation of the carboxy group of L-phenylalanine with the 3-hydroxy group of AMP.
3-[[5-bromo-1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-7-yl]sulfonyl]-N-[(5-methyl-2-furanyl)methyl]propanamide
4-(4-Acetyloxyphenyl)benzoic acid [2-[[2-(2-chloroanilino)-2-oxoethyl]-methylamino]-2-oxoethyl] ester
methyl N-(2,6-dichlorobenzoyl)-3-(2-phenoxy-6-quinolyl)alaninate
4-chloro-N-[(2R,3S,6R)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2S,3R,6R)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2S,3S,6R)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2S,3R,6S)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2S,3S,6S)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2R,3R,6R)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2R,3S,6S)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
4-chloro-N-[(2R,3R,6S)-6-[2-[4-(3-fluorophenyl)-1-triazolyl]ethyl]-2-(hydroxymethyl)-3-oxanyl]benzenesulfonamide
myricetin 5-O-glucuronide
A myricetin O-glucuronide that is myricetin with a beta-D-glucosiduronic acid residue attached at the 5-position.
myricetin 7-O-glucuronide
A myricetin O-glucuronide that is myricetin with a beta-D-glucosiduronic acid residue attached at the 7-position.
[(1S)-2-[2-[(2R)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]-2-carboxyethyl]selanyl-1H-imidazol-5-yl]-1-carboxyethyl]-trimethylazanium
2-(3,5-dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Syn-15-tert-butyl-18-methoxy-5,6,7,9-tetrafluoro-2,11-dithia(3.3)metacyclophane 2,2,11,11-tetraoxide
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-8-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
ALDH1A1-IN-2
ALDH1A1-IN-2 is a potent inhibitor of aldehyde dehydrogenase 1a1 (aldh1a1). Aldehyde dehydrogenases (ALDH) constitute a family of enzymes that play a critical role in oxidizing various cytotoxic xenogenic and biogenic aldehydes. ALDH1A1-IN-2 has the potential for the research of cancer, inflammation, or obesity (extracted from patent WO2019089626A1, compound 295)[1].
Uplarafenib
Uplarafenib (B-Raf IN 10) (Compound C09) is a BRAF inhibitor with an IC50 between 50 and 100 nM. Uplarafenib shows antitumor activity[1].
5,7-dihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl]chromen-4-one
1-bromo-8a-(bromomethyl)-6-hydroperoxy-8-isopropyl-4,10a-dimethyl-2,3,4a,6,7,8,9,10-octahydro-1h-phenanthrene-3,4-diol
(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl 3,4,5-trihydroxybenzoate
5,6,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-methoxy-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
3-(3,4-dihydroxyphenyl)-2-{[(2e)-3-{2-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-3,4-dihydroxyphenyl}prop-2-enoyl]oxy}propanoic acid
2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-3-methoxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
(2s,3r,4s,5r,6r)-2-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl 3,4,5-trihydroxybenzoate
2-(3,5-dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
3,4a-dichloro-10a-(3,7-dimethyl-6-oxoocta-2,7-dien-1-yl)-6,8-dihydroxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione
2-(3,5-dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2-(3,4-dihydroxyphenyl)-5,6-dihydroxy-7-methoxy-3-{[(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
2-[9-hydroxy-4,6-dimethyl-7-oxo-9-(3,4,5-trichloro-1h-pyrrol-2-yl)non-8-en-2-yl]-4-methyl-5h-1,3-thiazole-4-carboxylic acid
8-{3,4a-dichloro-6,8-dihydroxy-2,2-dimethyl-5,10-dioxo-3h,4h-naphtho[2,3-b]pyran-10a-yl}-2,6-dimethylocta-2,6-dienal
1-o-(e)-caffeoyl-3-o-galloyl-β-d-glucopyra-nose
{"Ingredient_id": "HBIN002898","Ingredient_name": "1-o-(e)-caffeoyl-3-o-galloyl-\u03b2-d-glucopyra-nose","Alias": "NA","Ingredient_formula": "C22H22O13","Ingredient_Smile": "C1=CC(=C(C=C1C=CC(=O)OC2C(C(C(C(O2)CO)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2902","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-(e)-caffeoyl-4-o-galloyl-β-d-glucopyra-nose
{"Ingredient_id": "HBIN009316","Ingredient_name": "3-o-(e)-caffeoyl-4-o-galloyl-\u03b2-d-glucopyra-nose","Alias": "NA","Ingredient_formula": "C22H22O13","Ingredient_Smile": "C1=CC(=C(C=C1C=CC(=O)OC2C(C(OC(C2OC(=O)C3=CC(=C(C(=C3)O)O)O)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2903","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5,7,3',4'-tetrahydroxy-8-methoxyflavonol-3-o-beta-d-galactoside
{"Ingredient_id": "HBIN011189","Ingredient_name": "5,7,3',4'-tetrahydroxy-8-methoxyflavonol-3-o-beta-d-galactoside","Alias": "5,7,3',4'-tetrahydroxy-8-methoxyflavonol-3-o-\u03b2-d-galactoside","Ingredient_formula": "C22H22O13","Ingredient_Smile": "COC1=C(C=C(C2=C1OC(=C(C2=O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32038;21111","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}