Exact Mass: 560.1505624
Exact Mass Matches: 560.1505624
Found 230 metabolites which its exact mass value is equals to given mass value 560.1505624
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Ensartinib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C141136 - ALK Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000970 - Antineoplastic Agents
Prunus inhibitor b
Prunus inhibitor b is found in fruits. Prunus inhibitor b is isolated from Prunus persica roots. Isolated from Prunus persica roots. Prunus inhibitor b is found in fruits.
Apimaysin
Apimaysin is found in cereals and cereal products. Apimaysin is isolated from corn silk (Zea mays). Isolated from corn silk (Zea mays). Apimaysin is found in cereals and cereal products and corn.
(2S,2'R,3S,3'R,4S)-3,4',5,7-Tetrahydroxyflavan(2->7,4->8)-3,3',5,5',7-pentahydroxyflavan
(2S,2R,3S,3R,4S)-3,4,5,7-Tetrahydroxyflavan(2->7,4->8)-3,3,5,5,7-pentahydroxyflavan is found in alcoholic beverages. (2S,2R,3S,3R,4S)-3,4,5,7-Tetrahydroxyflavan(2->7,4->8)-3,3,5,5,7-pentahydroxyflavan is a constituent of the branches of Prunus spinosa (sloe). Constituent of the branches of Prunus spinosa (sloe). (2S,2R,3S,3R,4S)-3,4,5,7-Tetrahydroxyflavan(2->7,4->8)-3,3,5,5,7-pentahydroxyflavan is found in alcoholic beverages, herbs and spices, and fruits.
13-(3,4-dihydroxyphenyl)-5-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0(2),(1)(1).0(3),.0(1),(2)]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
5'-(4-Hydroxy-(E)-cinnamoyl) alpha-L-arabinofuranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-D-xylopyranoside
5-(4-Hydroxy-(E)-cinnamoyl) alpha-L-arabinofuranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-D-xylopyranoside is found in green vegetables. 5-(4-Hydroxy-(E)-cinnamoyl) alpha-L-arabinofuranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-D-xylopyranoside is an enzyme hydrolysis product of bamboo shoot (Phyllostachys edulis) cell wall and of barley straw cell walls. Enzym. hydrol. product of bamboo shoot (Phyllostachys edulis) cell wall and of barley straw cell walls. 5-(4-Hydroxy-(E)-cinnamoyl) alpha-L-arabinofuranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-D-xylopyranoside is found in green vegetables.
Paeoniflorin sulfonate
ent-Epiafzelechin-(2alpha->7,4alpha->8)-catechin
Ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin is a member of the class of compounds known as biflavonoids and polyflavonoids. Biflavonoids and polyflavonoids are organic compounds containing at least two flavan/flavone units. These units are usually linked through CC or C-O-C bonds. Some examples include C2-O-C3, C2-O-C4, C3-C3, and C6-C8. Ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin can be found in peach, which makes ent-epiafzelechin-(2alpha->7,4alpha->8)-catechin a potential biomarker for the consumption of this food product.
Cassiaoccidentalin A
Herbacetin 8- (2',3',4'-triacetylxyloside)
Geranin B
Apimaysin
(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
4,4-O-dimethylellagic acid 3-(2,3-di-O-acetyl)-alpha-L-rhamnoside|4,4-O-Dimethylellagic acid 3-(2,3-di-O-acetyl)-??-L-rhamnoside
Steffimycin D
An anthracycline antibiotic that is steffimycin in which the carbonyl group that is adjacent to the carbon bearing both a hydroxy group and a methyl group has been reduced to the corresponding methylene group. An antitumour anthracycline first isolated from Streptomyces steffisburgensis.
3-O-rhamopyranosyl-(+)-catechin-(4alpha-2)-phloroglucinol
4xi,5xi-di(3,4-dihydroxy-(E)-cinnamoyl)-2,6xi-dihydroxyhept-2-en-1,7-dioic acid 1-methylester
beta-D-(1-acetyl-3-feruloyl)fructofuranosyl-alpha-D-glucopyranoside
3,5-dihydroxy-2-[(4-hydroxyphenyl)carbonyl]phenyl 6-O-[(3,4,5-trihydroxyphenyl)carbonyl]-beta-D-glucopyranoside|iriflophenone 2-O-(6-O-galloyl)-beta-D-glucopyranoside
(1R,2S,3R,4R,5S,7R)-4-hydroxy-7-hydroxymethyl-2,3-bis[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyloxy]-6,8-dioxabicyclo[3.2.1]octan-5-carboxylic acid|4,5-di-O-caffeoyl-2,7-anhydro-D-glycero-beta-D-galacto-oct-2-ulopyranosonic acid
torachrysone-8-O-beta-D-glucoside gallic acid ester
2alpha,3alpha-epoxyflavan-5,7,3,4-tetraol-(4beta?8)-flavan-5,7,4-triol
(E)-3,3?-(3-methylbutane-1,1-diyl)-bis-(6-((E)-3,4-dihydroxystyryl)-4-hydroxy-2H-pyran-2-one)|phaeolschidin B
2beta,3beta-epoxy-5,7,4?-trihydroxyflavan-(4alpha?8)-epicatechin
4xi,5xi-di(3,4-dihydroxy-(E)-cinnamoyl)-2,6xi-dihydroxyhept-2-en-1,7-dioic acid 7-methylester
(7R,11R,19R,23R)-2,4,14,16-tetrahydroxy-7,11,19,23-tetramethyl-7,8,11,12,19,20,23,24-octahydrodibenzo[g,q][1,5,11,15]tetraoxacycloicosine-5,9,17,21-tetraone|15G256iota
(6-O-feruroyl)-beta-D-fructofuranosyl-(6-O-acetyl)-alpha-D-glucopyranoside
5,7-dihydroxy-6-[(2S,3R,4R,6R)-4-hydroxy-6-methyl-5-oxo-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
[4,5-dihydroxy-6-(hydroxymethyl)-2-[2,4,6-trihydroxy-3-(4-hydroxybenzoyl)phenyl]oxan-3-yl] 3,4,5-trihydroxybenzoate
[4,5-dihydroxy-6-(hydroxymethyl)-2-[2,4,6-trihydroxy-3-(4-hydroxybenzoyl)phenyl]oxan-3-yl] 3,4,5-trihydroxybenzoate
5,7-dihydroxy-6-[(2S,3R,4R,6R)-4-hydroxy-6-methyl-5-oxo-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one [IIN-based: Match]
5,7-dihydroxy-6-[(2S,3R,4R,6R)-4-hydroxy-6-methyl-5-oxo-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one [IIN-based on: CCMSLIB00000847429]
(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid_major
(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,5-dihydroxy-4-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid_22.2\\%
Cys Glu Phe Tyr
Cys Glu Tyr Phe
Cys Phe Glu Tyr
Cys Phe Tyr Glu
Cys Tyr Glu Phe
Cys Tyr Phe Glu
Glu Cys Phe Tyr
Glu Cys Tyr Phe
Glu Phe Cys Tyr
Glu Phe Tyr Cys
Glu Tyr Cys Phe
Glu Tyr Phe Cys
Phe Cys Glu Tyr
Phe Cys Tyr Glu
Phe Glu Cys Tyr
Phe Glu Tyr Cys
Phe Tyr Cys Glu
Phe Tyr Glu Cys
Tyr Cys Glu Phe
Tyr Cys Phe Glu
Tyr Glu Cys Phe
Tyr Glu Phe Cys
Tyr Phe Cys Glu
Tyr Phe Glu Cys
Prunus inhibitor b
(2S,2'R,3S,3'R,4S)-3,4',5,7-Tetrahydroxyflavan(2->7,4->8)-3,3',5,5',7-pentahydroxyflavan
4-Coumaroyl arabinoxylan
1,5-Anhydro-2-O-(3,4,5-trihydroxybenzoyl)-1-[2,4,6-trihydroxy-3-(4-hydroxybenzoyl)phenyl]hexitol
Vardenafil dihydrochloride
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors > D058986 - Phosphodiesterase 5 Inhibitors C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor > C2127 - cGMP Phosphodiesterase Inhibitor D000089162 - Genitourinary Agents > D064804 - Urological Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-4-[[2-methoxy-5-methyl-4-[(methylamino)sulphonyl]phenyl]azo]naphthalene-2-carboxamide
C27H24N6O6S (560.1477964000001)
Sulfamazone
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01E - Sulfonamides and trimethoprim > J01ED - Long-acting sulfonamides C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluorooctadecane
3,6-Di-O-acetyl-4-O-(2,3,4,6-tetra-O-acetyl-beta-D-galactopyranosyl)-D-glucal
TERT-BUTYL 4-(((4-((4-BROMO-2-FLUOROPHENYL)AMINO)-6-METHOXYQUINAZOLIN-7-YL)OXY)METHYL)PIPERIDINE-1-CARBOXYLATE
4,4,4,4-(pyrazine-2,3,5,6-tetrayl)tetrabenzoic acid
C32H20N2O8 (560.1219600000001)
2,6-Bis([1,1-biphenyl]-4-yl)-4-phenylpyrylium perchlorate
Loprazolam mesylate
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants
[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl [(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] methyl phosphate
5,7-dihydroxy-6-[(2S,3R,4R,6R)-4-hydroxy-6-methyl-5-oxo-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
[8-Methyl-6-sulfooxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-2-yl]methyl benzoate
2-(3,5-Dimethoxy-4-hydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-8-oxo-8H-pyrano[4,3,2-de]-1-benzopyran-5-carboxylic acid
3-bromo-N-[2-[(3R,6S)-6-[(4-methoxyphenyl)methyl]-3-(phenylmethyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]ethyl]-4-methylbenzamide
C30H33BrN4O2 (560.1786738000001)
Paeoniflorin sulfonate
A monoterpene glycoside with formula C23H28O14S, originally isolated from the roots of Paeonia lactiflora.
beta-D-Araf-(1->2)-alpha-D-Araf-(1->3)-alpha-D-Araf-(1->5)-alpha-D-Araf-OMe
beta-D-Araf-(1->2)-alpha-D-Araf-(1->5)-alpha-D-Araf-(1->5)-alpha-D-Araf-OMe
(3aR,10bR)-3a-[2-(benzenesulfonyl)ethyl]-2-[4-(3-hydroxypropoxy)phenyl]-5-prop-2-enyl-6,10b-dihydrooxazolo[4,5-d][2]benzazepin-4-one
2-[(1S,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1S,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1R,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1R,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1R,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1S,3S,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
2-[(1R,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(4-chlorophenyl)methyl]acetamide
C27H26ClFN2O6S (560.1184058000001)
N-[(2R,4aS,12aS)-2-[2-(2,5-difluoroanilino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-4-cyanobenzamide
5,7-dihydroxy-6-[(2S,3R,5R)-5-hydroxy-6-methyl-4-oxo-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
6-[[6-(6,7-Dihydroxy-4-oxochromen-3-yl)-5-methoxy-2,2-dimethyl-3,4-dihydrochromen-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
[5-[3,5-dihydroxy-2-(1,3,4-trihydroxy-5-oxopentan-2-yl)oxyoxan-4-yl]oxy-3,4-dihydroxyoxolan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
Anti-virus agent 1
Anti-virus agent 1 (compound 4i), a phosphoramidate proagent of GS-5734 (HY-104077; Remdesivir), has potent antiviral activity. Anti-virus agent 1 is used for the research of coronavirus and Ebola virus (EBOV)[1][2].
2-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-4-hydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
[(1r,7s,9r,16r,18r,19r)-1,3,14-trihydroxy-19-{[(2s,5s,6s)-5-hydroxy-6-methyloxan-2-yl]oxy}-7,18-dimethyl-5,12-dioxo-8,17-dioxapentacyclo[14.2.2.0²,¹⁵.0⁴,¹³.0⁶,¹¹]icosa-2(15),3,6(11),13-tetraen-9-yl]acetic acid
[(2r,3s,4s,5r,6s)-6-{[(2r,3r)-3,5-dihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-4-oxo-2,3-dihydro-1-benzopyran-7-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate
(2r,3r,4s,5r,6r)-3-hydroxy-2-(hydroxymethyl)-5-{[2-(4-hydroxyphenyl)acetyl]oxy}-6-{[(2r,4r)-2-methyl-6-oxooxan-4-yl]oxy}oxan-4-yl 2-(4-hydroxyphenyl)acetate
1,6-bis[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl] phenazine-1,6-dicarboxylate
C26H28N2O12 (560.1642168000001)
2-[(1r,5r,10r,11r,13s)-5,11-dimethyl-6-oxo-2,4,9,12-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-13-yl]-1,6,10-trihydroxy-8-methyltetracene-5,12-dione
6-[2-(3,4-dihydroxyphenyl)ethenyl]-3-(1-{6-[2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-yl}-3-methylbutyl)-4-hydroxypyran-2-one
(5r,6r,7r,13s,14s,15r)-7,15-bis(4-hydroxyphenyl)-8,12,16-trioxapentacyclo[11.7.1.0²,¹¹.0⁴,⁹.0¹⁷,²¹]henicosa-1(21),2(11),3,9,17,19-hexaene-5,6,10,14,18,19-hexol
(1r,5s,6s,13s,21r)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
4,5-bis(acetyloxy)-2-[4-(3,5,7,8-tetrahydroxy-4-oxochromen-2-yl)phenoxy]oxan-3-yl acetate
{6-[3,5-dihydroxy-2-(4-hydroxybenzoyl)phenoxy]-3,4,5-trihydroxyoxan-2-yl}methyl 3,4,5-trihydroxybenzoate
2-hydroxy-6-[hydroxy({1,4,6,9,10-pentahydroxy-5,13-dioxo-8h,9h,10h,12ah-indeno[1,2-a]anthracen-8a-yl})methyl]-4-methylbenzoic acid
(2s,3r,4s,5s,6r)-2-{[(1s,4as,5s,6r,7r,7as)-6-chloro-5,7-dihydroxy-4-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H33ClO15 (560.1507898000001)
3-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxy-4-{[3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
3-O-caffeoyl-4-Osinapoylquinic acid
{"Ingredient_id": "HBIN009278","Ingredient_name": "3-O-caffeoyl-4-Osinapoylquinic acid","Alias": "NA","Ingredient_formula": "C27H28O13","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C=CC(=O)OC2C(CC(CC2OC(=O)C=CC3=CC(=C(C=C3)O)O)(C(=O)O)O)O","Ingredient_weight": "560.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40183","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101522313","DrugBank_id": "NA"}
3-o-caffeoyl-4-o-sinapoylquinicacid
{"Ingredient_id": "HBIN009279","Ingredient_name": "3-o-caffeoyl-4-o-sinapoylquinicacid","Alias": "3-o-caffeoyl-4-o-sinapoylquinic acid","Ingredient_formula": "C27H28O13","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C=CC(=O)OC2C(CC(CC2OC(=O)C=CC3=CC(=C(C=C3)O)O)(C(=O)O)O)O","Ingredient_weight": "560.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14549","TCMID_id": "30714;2925","TCMSP_id": "NA","TCM_ID_id": "8023","PubChem_id": "101522313","DrugBank_id": "NA"}
4,4'-o-dimethylellagicacid3-(2'',3''-di-o-acetyl)-α-l-rhamnoside
{"Ingredient_id": "HBIN009970","Ingredient_name": "4,4'-o-dimethylellagicacid3-(2'',3''-di-o-acetyl)-\u03b1-l-rhamnoside","Alias": "NA","Ingredient_formula": "C26H24O14","Ingredient_Smile": "CC1C(C(C(C(O1)OC2=C(C=C3C4=C2OC(=O)C5=CC(=C(C(=C54)OC3=O)O)OC)OC)OC(=O)C)OC(=O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6345","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
12,14,26,28-tetrahydroxy-4,8,18,22-tetramethyl-3,7,17,21-tetraoxatricyclo[22.4.0.0¹⁰,¹⁵]octacosa-1(28),10,12,14,24,26-hexaene-2,6,16,20-tetrone
[(2r,3s,4s,5r,6s)-6-[3,5-dihydroxy-2-(4-hydroxybenzoyl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
(1s,17r,20r)-20-{[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-3,7,9-trihydroxy-17-methyl-16,21-dioxapentacyclo[15.3.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]henicosa-2,4(13),6,8,10,14-hexaene-5,12-dione
[(1s,7s,9s,16s,18s,19r)-1,3,14-trihydroxy-19-{[(2s,5s,6r)-5-hydroxy-6-methyloxan-2-yl]oxy}-7,18-dimethyl-5,12-dioxo-8,17-dioxapentacyclo[14.2.2.0²,¹⁵.0⁴,¹³.0⁶,¹¹]icosa-2(15),3,6(11),13-tetraen-9-yl]acetic acid
(2s,3s,4r,5r)-2-[(acetyloxy)methyl]-4-hydroxy-5-(hydroxymethyl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
19-(acetyloxy)-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0⁵,⁷.0¹⁵,²¹.0¹⁶,¹⁸]tetracosa-9,20-dien-8-yl hexanoate
11-[1-(acetyloxy)ethyl]-16-methyl-1,6,13,22-tetraazaheptacyclo[15.11.1.0²,¹⁵.0⁵,¹⁴.0⁷,¹².0²¹,²⁹.0²³,²⁸]nonacosa-2(15),3,5,7,9,11,13,17,19,21(29),23,25,27-tridecaene-4,24-dicarboxylic acid
(1s,3r)-3-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxy-4-{[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
(2r,3r)-8-[(3r,5s,6s)-8,10-dihydroxy-3-(4-hydroxyphenyl)-2,4-dioxatricyclo[5.4.0.0³,⁵]undeca-1(11),7,9-trien-6-yl]-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
2-[(acetyloxy)methyl]-4-hydroxy-5-(hydroxymethyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
11-{[(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]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one
C26H28N2O12 (560.1642168000001)
3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one
C26H28N2O12 (560.1642168000001)
(1r,5r,6s,13s,21s)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
5,7-dihydroxy-6-{5-hydroxy-6-methyl-4-oxo-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}-2-(4-hydroxyphenyl)chromen-4-one
27-methoxy-22-methyl-15,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.2¹⁶,¹⁹.1⁴,³⁰.1¹⁰,¹⁴.0³,⁸.0²⁵,³³.0²⁸,³²]heptatriaconta-1,3(8),4,6,10,12,14(37),16,18,25(33),26,28(32),30(34),35-tetradecaene-13,26-diol
3-{[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-({[(2r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one
C26H28N2O12 (560.1642168000001)
methyl (1r,3r,4r,7r,8s,11r,12s,15s,16s)-12-(acetyloxy)-16-(furan-3-yl)-11-hydroxy-4,9,9,15-tetramethyl-5,10,18-trioxo-2,6,17-trioxapentacyclo[10.7.0.0¹,¹⁵.0³,¹¹.0⁴,⁸]nonadecane-7-carboxylate
(5r,6r,7r,13s,14s,15s)-7,15-bis(4-hydroxyphenyl)-8,12,16-trioxapentacyclo[11.7.1.0²,¹¹.0⁴,⁹.0¹⁷,²¹]henicosa-1(21),2(11),3,9,17,19-hexaene-5,6,10,14,18,19-hexol
3-(2,4-dihydroxyphenyl)-7-(6-hydroxy-1-benzofuran-2-yl)-13-methyl-4,14-dioxapentacyclo[11.7.1.0²,¹¹.0⁵,¹⁰.0¹⁵,²⁰]henicosa-2,5,7,9,11,15,17,19-octaene-9,17-diol
(2s,3s,4r,5r)-2-{[(2r,3r,4s,5s,6r)-6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-4-hydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
5,7-dihydroxy-6-[(2s,3r,5s,6r)-5-hydroxy-6-methyl-4-oxo-3-{[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
(1r,5r,6s,13s,21s)-13-(3,4-dihydroxyphenyl)-5-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
4,5-bis(acetyloxy)-2-{[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]oxy}oxan-3-yl acetate
(1r,3s,4s,5s)-3-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxy-4-{[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
5,7-dihydroxy-6-[(2r,3r,5s,6s)-5-hydroxy-6-methyl-4-oxo-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-2-(4-hydroxyphenyl)chromen-4-one
(1r,4s,5r,7s,8s,12r,15s,16r,18s,19s)-19-(butanoyloxy)-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0⁵,⁷.0¹⁵,²¹.0¹⁶,¹⁸]tetracosa-9,20-dien-8-yl butanoate
(1s,5r,6s,13r,21s)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
8-{9,10-dihydroxy-7-methoxy-3-methyl-1-oxo-3h,4h-naphtho[2,3-c]pyran-8-yl}-10-hydroxy-7-methoxy-3-methyl-3h,4h-naphtho[2,3-c]pyran-1,6,9-trione
(3r,4s,5r,6s)-4,5-bis(acetyloxy)-6-[4-(3,5,7,8-tetrahydroxy-4-oxochromen-2-yl)phenoxy]oxan-3-yl acetate
2-[(6-chloro-5,7-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl)methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
C21H33ClO15 (560.1507898000001)
(6-{[3,5-dihydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-4-oxo-2,3-dihydro-1-benzopyran-7-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methyl acetate
3-(acetyloxy)-5-hydroxy-2-({14-hydroxy-6,13-dimethoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaen-7-yl}oxy)-6-methyloxan-4-yl acetate
methyl 12-(acetyloxy)-16-(furan-3-yl)-11-hydroxy-4,9,9,15-tetramethyl-5,10,18-trioxo-2,6,17-trioxapentacyclo[10.7.0.0¹,¹⁵.0³,¹¹.0⁴,⁸]nonadecane-7-carboxylate
3-{[(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]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one
C26H28N2O12 (560.1642168000001)
(21s)-27-methoxy-22-methyl-15,29,31-trioxa-7,22-diazaoctacyclo[19.9.3.2¹⁶,¹⁹.1⁴,³⁰.1¹⁰,¹⁴.0³,⁸.0²⁵,³³.0²⁸,³²]heptatriaconta-1,3(8),4,6,10,12,14(37),16,18,25(33),26,28(32),30(34),35-tetradecaene-13,26-diol
(1r,12s,13r,14r,21s,22r)-4,6,8,13,16,18-hexahydroxy-22-[(4-hydroxy-6-oxopyran-2-yl)methyl]-14-methylhexacyclo[17.3.1.0²,⁷.0⁹,²².0¹²,²¹.0¹⁵,²⁰]tricosa-2,4,6,8,15,17,19-heptaene-10,23-dione
(1r,5r,6s,13s,21r)-13-(3,4-dihydroxyphenyl)-5-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
(1s,5r,6r,13r,21s)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
4,6,8,13,16,18-hexahydroxy-22-[(4-hydroxy-6-oxopyran-2-yl)methyl]-14-methylhexacyclo[17.3.1.0²,⁷.0⁹,²².0¹²,²¹.0¹⁵,²⁰]tricosa-2,4,6,8,15,17,19-heptaene-10,23-dione
20-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-3,7,9-trihydroxy-17-methyl-16,21-dioxapentacyclo[15.3.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹]henicosa-2,4(13),6,8,10,14-hexaene-5,12-dione
(4r,8r,18r,22r)-12,14,26,28-tetrahydroxy-4,8,18,22-tetramethyl-3,7,17,21-tetraoxatricyclo[22.4.0.0¹⁰,¹⁵]octacosa-1(28),10,12,14,24,26-hexaene-2,6,16,20-tetrone
1,6-bis(3,4,5-trihydroxy-6-methyloxan-2-yl) phenazine-1,6-dicarboxylate
C26H28N2O12 (560.1642168000001)
(3r,4s,5s,6s)-4,5-bis(acetyloxy)-6-{[3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl]oxy}oxan-3-yl acetate
6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-3-(1-{6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-yl}-3-methylbutyl)-4-hydroxypyran-2-one
19-(butanoyloxy)-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0⁵,⁷.0¹⁵,²¹.0¹⁶,¹⁸]tetracosa-9,20-dien-8-yl butanoate
2-[(1r,3r,5s,8s,10r,12r,14r)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-12-yl]-1,6,10-trihydroxy-8-methyltetracene-5,12-dione
(1s,5s,6r,13r,21s)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
6-[(2r,4r,5r,6r)-4,5-dihydroxy-6-methyloxan-2-yl]-5-hydroxy-7-methoxy-2-{4-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}chromen-4-one
9-[(1r,5r,10r,11r,13s)-5,11-dimethyl-6-oxo-2,4,9,12-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-13-yl]-1,5,8-trihydroxy-3-methyltetraphene-7,12-dione
7,15-bis(4-hydroxyphenyl)-8,12,16-trioxapentacyclo[11.7.1.0²,¹¹.0⁴,⁹.0¹⁷,²¹]henicosa-1(21),2,4(9),10,17,19-hexaene-5,6,10,14,18,19-hexol
(2s,3r,4r,5s,6s)-3-(acetyloxy)-5-hydroxy-2-({14-hydroxy-6,13-dimethoxy-3,10-dioxo-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaen-7-yl}oxy)-6-methyloxan-4-yl acetate
(1s,3r,4r,5r)-3-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,5-dihydroxy-4-{[(2e)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
(1r,5r,6s,13s,21r)-5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0²,¹¹.0³,⁸.0¹⁵,²⁰]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
1',4-dihydroxy-7'-(8-hydroxy-6-methyl-1,4-dioxonaphthalen-2-yl)-2,3'-dimethyl-[1,2'-binaphthalene]-5,5',8,8'-tetrone
(8r,9s)-10-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-6,8,9,11-tetrahydroxy-1-methoxy-2,8-dimethyl-9,10-dihydro-7h-tetracene-5,12-dione
2-[(s)-[(8as,9s,10r,12ar)-1,4,6,9,10-pentahydroxy-5,13-dioxo-8h,9h,10h,12ah-indeno[1,2-a]anthracen-8a-yl](hydroxy)methyl]-6-hydroxy-4-methylbenzoic acid
10-[(4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl)oxy]-1,8,11-trihydroxy-3,9-dimethoxy-8-methyl-9,10-dihydro-7h-tetracene-5,12-dione
(1r,4s,5r,7s,8s,12r,15s,16r,18s,19s)-19-(acetyloxy)-2,13-dioxo-6,17-dioxa-23,24-dithia-3,14-diazaoctacyclo[10.10.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0⁵,⁷.0¹⁵,²¹.0¹⁶,¹⁸]tetracosa-9,20-dien-8-yl hexanoate
(1r,2s,3r,4r,5s,7r)-2,3-bis({[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})-4-hydroxy-7-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-5-carboxylic acid
2-[(s)-[(8ar,9s,10r,12ar)-1,4,6,9,10-pentahydroxy-5,13-dioxo-8h,9h,10h,12ah-indeno[1,2-a]anthracen-8a-yl](hydroxy)methyl]-6-hydroxy-4-methylbenzoic acid
11-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-2-one
C26H28N2O12 (560.1642168000001)