Exact Mass: 666.2042280000001
Exact Mass Matches: 666.2042280000001
Found 39 metabolites which its exact mass value is equals to given mass value 666.2042280000001,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Dicerandrol A
Dicerandrol A
A biaryl that is 5,5,7,7,9,9,10a,10a-octahydro-6H,6H-2,2-bixanthene substituted by acetoxy groups at C-5 and C-5, hydroxy groups at C-1, C-1, C-8 and C-8, hydroxymethyl groups at C-10a and C-10a, methyl groups at C-6 and C-6 and oxo groups at C-9 and C-9 respectively. A dimeric tetrahydroxanthone derivative isolated from Phomopsis longicolla, it exhibits antibacterial and cytotoxic activities.
4-[4-[3,5-bis[4-(4-carboxyphenyl)phenyl]phenyl]phenyl]benzoic acid
4-[4-[3,5-bis[4-(4-carboxyphenyl)phenyl]phenyl]phenyl]benzoic acid
1-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
C31H34F4N4O6S (666.2135072000001)
1-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
C31H34F4N4O6S (666.2135072000001)
1-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
C31H34F4N4O6S (666.2135072000001)
1-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
C31H34F4N4O6S (666.2135072000001)
1-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3R)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
C31H34F4N4O6S (666.2135072000001)
1-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3S)-2-[[(4-fluorophenyl)sulfonyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
C31H34F4N4O6S (666.2135072000001)
6-[2-[6-carboxy-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-3-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[2-[6-carboxy-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-5-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-3-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[4-[(E)-2-[4-[6-carboxy-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-3,5-dihydroxyphenyl]ethenyl]-3-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[4-[(E)-2-[4-[6-carboxy-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-3,5-dihydroxyphenyl]ethenyl]-3-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[6-(2,4-dihydroxyphenyl)-2-[4-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-2,6-dihydroxyphenyl]-4-methylcyclohex-3-ene-1-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[6-(2,4-dihydroxyphenyl)-2-[4-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-2,6-dihydroxyphenyl]-4-methylcyclohex-3-ene-1-carbonyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
{8-[5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-(3-methyl-5-oxooxolan-2-yl)-4-oxo-3h-1-benzopyran-2-yl}methyl acetate
{8-[5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-(3-methyl-5-oxooxolan-2-yl)-4-oxo-3h-1-benzopyran-2-yl}methyl acetate
[5'-(acetyloxy)-1,1',5,9,9'-pentahydroxy-10'a-(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-10a-yl]methyl acetate
[5'-(acetyloxy)-1,1',5,9,9'-pentahydroxy-10'a-(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-10a-yl]methyl acetate
(2s,3r,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14s)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
(2s,3r,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14s)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14r)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14r)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
(5r,5'r,6r,6'r,10ar,10'ar)-5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
(5r,5'r,6r,6'r,10ar,10'ar)-5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11r,14r)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11r,14r)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
[(2s)-6-[(5r,6r,10ar)-5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-[(2r,3r)-3-methyl-5-oxooxolan-2-yl]-4-oxo-3h-1-benzopyran-2-yl]methyl acetate
[(2s)-6-[(5r,6r,10ar)-5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-[(2r,3r)-3-methyl-5-oxooxolan-2-yl]-4-oxo-3h-1-benzopyran-2-yl]methyl acetate
(5r,5'r,6r,6'r,10ar,10'ar)-5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
(5r,5'r,6r,6'r,10ar,10'ar)-5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
[(2r)-8-[(5r,6r,10ar)-5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-[(2s,3s)-3-methyl-5-oxooxolan-2-yl]-4-oxo-3h-1-benzopyran-2-yl]methyl acetate
[(2r)-8-[(5r,6r,10ar)-5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-[(2s,3s)-3-methyl-5-oxooxolan-2-yl]-4-oxo-3h-1-benzopyran-2-yl]methyl acetate
5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
(5s,5's,6s,6's,10as,10'as)-5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
(5s,5's,6s,6's,10as,10'as)-5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14s)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14s)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
(5r,5'r,6r,6'r,10ar,10'ar)-5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
(5r,5'r,6r,6'r,10ar,10'ar)-5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
(2s,3r,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14r)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
(2s,3r,6r)-6-bromo-2-[(3r)-3-[(1r,3s,6r,8r,11s,14r)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
(5s,5's,6s,6's,10as,10'as)-5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
(5s,5's,6s,6's,10as,10'as)-5'-(acetyloxy)-1,1',8,8'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-9,9'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-5-yl acetate
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1s,3r,6s,8s,11r,14s)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
(2s,3s,6r)-6-bromo-2-[(3r)-3-[(1s,3r,6s,8s,11r,14s)-14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl]-3-hydroxybutyl]-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
[(5s,5's,6s,6's,10as,10'as)-5'-(acetyloxy)-1,1',5,9,9'-pentahydroxy-10'a-(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-10a-yl]methyl acetate
[(5s,5's,6s,6's,10as,10'as)-5'-(acetyloxy)-1,1',5,9,9'-pentahydroxy-10'a-(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,2'-bixanthen]-10a-yl]methyl acetate
{6-[5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-(3-methyl-5-oxooxolan-2-yl)-4-oxo-3h-1-benzopyran-2-yl}methyl acetate
{6-[5-(acetyloxy)-1,9-dihydroxy-10a-(hydroxymethyl)-6-methyl-8-oxo-6,7-dihydro-5h-xanthen-2-yl]-5-hydroxy-2-(3-methyl-5-oxooxolan-2-yl)-4-oxo-3h-1-benzopyran-2-yl}methyl acetate
6-bromo-2-(3-{14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl}-3-hydroxybutyl)-3,7,7-trimethyloxepan-3-ol
6-bromo-2-(3-{14-bromo-1,8,13,13-tetramethyl-2,7,12-trioxatricyclo[9.5.0.0³,⁸]hexadecan-6-yl}-3-hydroxybutyl)-3,7,7-trimethyloxepan-3-ol
C30H52Br2O6 (666.2130411999999)
11-{13,13-dimethyl-4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0³,⁷.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2(10),3(7),8,11,14,16,18(22)-octaen-13-ium-11-yl}-13,13-dimethyl-4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0³,⁷.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2(10),3(7),8,11,14,16,18(22)-octaen-13-ium
11-{13,13-dimethyl-4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0³,⁷.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2(10),3(7),8,11,14,16,18(22)-octaen-13-ium-11-yl}-13,13-dimethyl-4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0³,⁷.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2(10),3(7),8,11,14,16,18(22)-octaen-13-ium
[C40H30N2O8]2+ (666.2002060000001)
5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate
5'-(acetyloxy)-1,1',9,9'-tetrahydroxy-10a,10'a-bis(hydroxymethyl)-6,6'-dimethyl-8,8'-dioxo-5h,5'h,6h,6'h,7h,7'h-[2,4'-bixanthen]-5-yl acetate