Exact Mass: 648.2359

Exact Mass Matches: 648.2359

Found 36 metabolites which its exact mass value is equals to given mass value 648.2359, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

3-(Hydroxy)phthioceranyl-2-palmitoyl(stearoyl)-2-O-sulfo-alpha,alpha-trehalose

3-(Hydroxy)phthioceranyl-2-palmitoyl(stearoyl)-2-O-sulfo-alpha,alpha-trehalose

C25H44O17S (648.2299)


   

Chalcomoracin

2-{6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl}-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


Chalcomoracin is found in fruits. Phytoalexin from diseased white mulberry (Morus alba

   

SCHEMBL16558846

SCHEMBL16558846

C39H36O9 (648.2359)


   

2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, 5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 4,6,7,10-tetraacetate-5-benzoate, [3R-(3.alpha.,4.alpha.,5.alpha.,5a.alpha.,6.alpha.,7.alpha.,9.beta.,9a.alpha.,10R*)]-

2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, 5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 4,6,7,10-tetraacetate-5-benzoate, [3R-(3.alpha.,4.alpha.,5.alpha.,5a.alpha.,6.alpha.,7.alpha.,9.beta.,9a.alpha.,10R*)]-

C32H40O14 (648.2418)


   

Mulberrofuran U

Mulberrofuran U

C39H36O9 (648.2359)


   

[(1S,6S,7R,10R,15S,16R,18S,19R,20R)-6-(3-Furyl)-8,9,18,19,20-pentahydroxy-3-(1-hydroxy-2-methylpropylidene)-7,12,15,17-tetramethyl-4-oxo-5,11,13,21-tetraoxaheptacyclo[10.8.1.114,17.01,10.02,7.010,15.014,19]docos-16-yl]acetic acid

[(1S,6S,7R,10R,15S,16R,18S,19R,20R)-6-(3-Furyl)-8,9,18,19,20-pentahydroxy-3-(1-hydroxy-2-methylpropylidene)-7,12,15,17-tetramethyl-4-oxo-5,11,13,21-tetraoxaheptacyclo[10.8.1.114,17.01,10.02,7.010,15.014,19]docos-16-yl]acetic acid

C32H40O14 (648.2418)


   

6-O-beta-D-Glycopyranosyl,hexa-Ac-4,12-Tetradecadiene-8,10-diyne-1,6,7-triol,

6-O-beta-D-Glycopyranosyl,hexa-Ac-4,12-Tetradecadiene-8,10-diyne-1,6,7-triol,

C32H40O14 (648.2418)


   

Egonol gentiobioside

Egonol gentiobioside

C32H40O14 (648.2418)


   

CHALCOMORACIN

2-(6-{[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)phenyl]carbonyl}-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl)-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

17-O-beta-D-Glucopyranside-Isocycloatalantin

17-O-beta-D-Glucopyranside-Isocycloatalantin

C32H40O14 (648.2418)


   

chuktabularin J

chuktabularin J

C32H40O14 (648.2418)


   

HYDROLYSIS PRODUCT OF BUSSEIN

HYDROLYSIS PRODUCT OF BUSSEIN

C32H40O14 (648.2418)


   

N-[3,5-bis(trifluoroMethyl)phenyl]-N-[(1S,2S)-2-[(11bR)-3,5-dihydro-4H-dinaphth[2,1-c:1,2-e]azepin-4-yl]cyclohexyl]-Urea

N-[3,5-bis(trifluoroMethyl)phenyl]-N-[(1S,2S)-2-[(11bR)-3,5-dihydro-4H-dinaphth[2,1-c:1,2-e]azepin-4-yl]cyclohexyl]-Urea

C37H32F6N3O (648.2449)


   

N-[3,5-bis(trifluoroMethyl)phenyl]-N-[(1R,2R)-2-[(11bR)-3,5-dihydro-4H-dinaphth[2,1-c:1,2-e]azepin-4-yl]cyclohexyl]-Urea

N-[3,5-bis(trifluoroMethyl)phenyl]-N-[(1R,2R)-2-[(11bR)-3,5-dihydro-4H-dinaphth[2,1-c:1,2-e]azepin-4-yl]cyclohexyl]-Urea

C37H32F6N3O (648.2449)


   

2-[5-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]penta-1,3-dienyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt

2-[5-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]penta-1,3-dienyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt

C33H41N2NaO6S2 (648.2304)


   

Sorocenol H

Sorocenol H

C39H36O9 (648.2359)


A member of the class of 1-benzofurans isolated from Sorocea muriculata that has been shown to exhibit antibacterial activity against methicillin-resistant Staphylococcus aureus.

   

ST 26:7;O8;GlcA

ST 26:7;O8;GlcA

C32H40O14 (648.2418)


   

(1r,2r,4r,5s,6r,7r,8s,9s,12s)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

(1r,2r,4r,5s,6r,7r,8s,9s,12s)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

C32H40O14 (648.2418)


   

1α,2α,6β,8β,13-pentaacetoxy-9β-benzoyloxy-4β-hydroxy-β-dihydroagarofuran

NA

C32H40O14 (648.2418)


{"Ingredient_id": "HBIN002268","Ingredient_name": "1\u03b1,2\u03b1,6\u03b2,8\u03b2,13-pentaacetoxy-9\u03b2-benzoyloxy-4\u03b2-hydroxy-\u03b2-dihydroagarofuran","Alias": "NA","Ingredient_formula": "C32H40O14","Ingredient_Smile": "CC(=O)OCC12C(C(CC(C13C(C(C(C2OC(=O)C4=CC=CC=C4)OC(=O)C)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16804","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-[(1s,2s,6s)-6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

4-[(1s,2s,6s)-6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

C32H40O14 (648.2418)


   

4-[(1r,2r,6s)-6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

4-[(1r,2r,6s)-6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

(1s,2s,4s,5r,6s,7s,8r,9r,12r)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

(1s,2s,4s,5r,6s,7s,8r,9r,12r)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

C32H40O14 (648.2418)


   

2-[(1s,5r,6r)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

2-[(1s,5r,6r)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

2-[(1s,4s,5r)-5-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-4-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

2-[(1s,4s,5r)-5-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-4-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

4-[6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

4-[6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

(1s,2s,4s,5r,6s,7r,8s,9r,12r)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

(1s,2s,4s,5r,6s,7r,8s,9r,12r)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate

C32H40O14 (648.2418)


   

2-[(1r,5r,6s)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

2-[(1r,5r,6s)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

(8r)-10-({5-[(4,5-dihydroxy-6-methyloxan-2-yl)oxy]-4-hydroxy-6-methyloxan-2-yl}oxy)-8-ethyl-1,6,7,8,11-pentahydroxy-7,9,10,11a-tetrahydro-5ah-tetracene-5,12-dione

(8r)-10-({5-[(4,5-dihydroxy-6-methyloxan-2-yl)oxy]-4-hydroxy-6-methyloxan-2-yl}oxy)-8-ethyl-1,6,7,8,11-pentahydroxy-7,9,10,11a-tetrahydro-5ah-tetracene-5,12-dione

C32H40O14 (648.2418)


   

(s)-[(1s,2r,3r,5s,7r,8s,9r,10r,11r,12s,17s,18r,20r,21s)-21-(acetyloxy)-5-ethyl-1,9,10,11,20-pentahydroxy-8,18-dimethyl-15-oxo-4,14,22-trioxaheptacyclo[16.2.1.1²,⁵.0³,⁷.0³,¹¹.0¹²,¹⁷.0¹²,²⁰]docosan-8-yl](furan-3-yl)methyl acetate

(s)-[(1s,2r,3r,5s,7r,8s,9r,10r,11r,12s,17s,18r,20r,21s)-21-(acetyloxy)-5-ethyl-1,9,10,11,20-pentahydroxy-8,18-dimethyl-15-oxo-4,14,22-trioxaheptacyclo[16.2.1.1²,⁵.0³,⁷.0³,¹¹.0¹²,¹⁷.0¹²,²⁰]docosan-8-yl](furan-3-yl)methyl acetate

C32H40O14 (648.2418)


   

2-[(1s,5s,6r)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[6-hydroxy-7-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol

2-[(1s,5s,6r)-6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[6-hydroxy-7-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol

C39H36O9 (648.2359)


   

2-[(1r,5s,6r)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

2-[(1r,5s,6r)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

2-[(1s,5s,6r)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

2-[(1s,5s,6r)-6-[2,4-dihydroxy-3-(3-methylbut-2-en-1-yl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-(6-hydroxy-1-benzofuran-2-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

[21-(acetyloxy)-5-ethyl-1,9,10,11,20-pentahydroxy-8,18-dimethyl-15-oxo-4,14,22-trioxaheptacyclo[16.2.1.1²,⁵.0³,⁷.0³,¹¹.0¹²,¹⁷.0¹²,²⁰]docosan-8-yl](furan-3-yl)methyl acetate

[21-(acetyloxy)-5-ethyl-1,9,10,11,20-pentahydroxy-8,18-dimethyl-15-oxo-4,14,22-trioxaheptacyclo[16.2.1.1²,⁵.0³,⁷.0³,¹¹.0¹²,¹⁷.0¹²,²⁰]docosan-8-yl](furan-3-yl)methyl acetate

C32H40O14 (648.2418)


   

4-[(1r,2s,6s)-6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

4-[(1r,2s,6s)-6-(2,4-dihydroxyphenyl)-2-[2-(3,5-dihydroxyphenyl)-6-hydroxy-1-benzofuran-5-yl]-4-methylcyclohex-3-ene-1-carbonyl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol

C39H36O9 (648.2359)


   

2-[6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[6-hydroxy-7-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol

2-[6-(2,4-dihydroxybenzoyl)-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[6-hydroxy-7-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]benzene-1,3-diol

C39H36O9 (648.2359)