Exact Mass: 1066.0754384

Exact Mass Matches: 1066.0754384

Found 51 metabolites which its exact mass value is equals to given mass value 1066.0754384, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Grandinin

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-(2,3,4,5-tetrahydroxyoxan-2-yl)-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5(10),6,8,11(16),12,14,23(28),24,26,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

Grandinin is a member of the class of compounds known as hydrolyzable tannins. Hydrolyzable tannins are tannins with a structure characterized by either of the following models. In model 1, the structure contains galloyl units (in some cases, shikimic acid units) are linked to diverse polyol carbohydrate-, catechin-, or triterpenoid units. In model 2, contains at least two galloyl units C-C coupled to each other, and do not contain a glycosidically linked catechin unit. Grandinin is soluble (in water) and a very weakly acidic compound (based on its pKa). Grandinin can be found in guava, which makes grandinin a potential biomarker for the consumption of this food product. Grandinin is an ellagitannin. It can be found in Melaleuca quinquenervia leaves and in oaks species like the North American white oak (Quercus alba) and European red oak (Quercus robur). It shows antioxydant activity. It is an astringent compound. It is also found in wine, red or white, aged in oak barrels .

(20Z,23Z,26Z)-N-(1,3-dihydroxyoctatriacontan-2-yl)tetratriaconta-20,23,26-trienamide

C72H139NO3 (1066.0754384)

(29Z,32Z)-N-[(E)-1,3-dihydroxydotriacont-4-en-2-yl]tetraconta-29,32-dienamide

C72H139NO3 (1066.0754384)

(Z)-N-[(4E,8E)-1,3-dihydroxydotriaconta-4,8-dien-2-yl]tetracont-29-enamide

C72H139NO3 (1066.0754384)

(25Z,28Z)-N-[(E)-1,3-dihydroxyhexatriacont-4-en-2-yl]hexatriaconta-25,28-dienamide

C72H139NO3 (1066.0754384)

(Z)-N-[(4E,8E)-1,3-dihydroxyhexatriaconta-4,8-dien-2-yl]hexatriacont-25-enamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxyhentriaconta-4,8,12-trien-2-yl]hentetracontanamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxytetratriaconta-4,8,12-trien-2-yl]octatriacontanamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxyoctatriaconta-4,8,12-trien-2-yl]tetratriacontanamide

C72H139NO3 (1066.0754384)

(23Z,26Z)-N-[(E)-1,3-dihydroxyoctatriacont-4-en-2-yl]tetratriaconta-23,26-dienamide

C72H139NO3 (1066.0754384)

(Z)-N-[(4E,8E)-1,3-dihydroxyoctatriaconta-4,8-dien-2-yl]tetratriacont-23-enamide

C72H139NO3 (1066.0754384)

(Z)-N-[(4E,8E)-1,3-dihydroxytetratriaconta-4,8-dien-2-yl]octatriacont-27-enamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxynonacosa-4,8,12-trien-2-yl]tritetracontanamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxyhexatriaconta-4,8,12-trien-2-yl]hexatriacontanamide

C72H139NO3 (1066.0754384)

(26Z,29Z,32Z)-N-(1,3-dihydroxydotriacontan-2-yl)tetraconta-26,29,32-trienamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxytritriaconta-4,8,12-trien-2-yl]nonatriacontanamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxyoctacosa-4,8,12-trien-2-yl]tetratetracontanamide

C72H139NO3 (1066.0754384)

(22Z,25Z,28Z)-N-(1,3-dihydroxyhexatriacontan-2-yl)hexatriaconta-22,25,28-trienamide

C72H139NO3 (1066.0754384)

(30Z,33Z,36Z)-N-(1,3-dihydroxyoctacosan-2-yl)tetratetraconta-30,33,36-trienamide

C72H139NO3 (1066.0754384)

(Z)-N-[(4E,8E)-1,3-dihydroxytriaconta-4,8-dien-2-yl]dotetracont-31-enamide

C72H139NO3 (1066.0754384)

(31Z,34Z)-N-[(E)-1,3-dihydroxytriacont-4-en-2-yl]dotetraconta-31,34-dienamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxyheptatriaconta-4,8,12-trien-2-yl]pentatriacontanamide

C72H139NO3 (1066.0754384)

(33Z,36Z)-N-[(E)-1,3-dihydroxyoctacos-4-en-2-yl]tetratetraconta-33,36-dienamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxydotriaconta-4,8,12-trien-2-yl]tetracontanamide

C72H139NO3 (1066.0754384)

N-[(4E,8E,12E)-1,3-dihydroxypentatriaconta-4,8,12-trien-2-yl]heptatriacontanamide

C72H139NO3 (1066.0754384)

(Z)-N-[(4E,8E)-1,3-dihydroxyoctacosa-4,8-dien-2-yl]tetratetracont-33-enamide

C72H139NO3 (1066.0754384)

Cer-NP t71:4

C71H135NO4 (1066.039055)

N-[(4E,8E,12E)-1,3-dihydroxytriaconta-4,8,12-trien-2-yl]dotetracontanamide

C72H139NO3 (1066.0754384)

Cer 29:2;2O/42:2;(3OH)

C71H135NO4 (1066.039055)

Cer 29:3;2O/42:1;(3OH)

C71H135NO4 (1066.039055)

Cer 29:2;2O/42:2;(2OH)

C71H135NO4 (1066.039055)

Cer 29:3;2O/42:1;(2OH)

C71H135NO4 (1066.039055)

(Z)-N-[(4E,8E)-1,3-dihydroxytriaconta-4,8-dien-2-yl]dotetracont-21-enamide

C72H139NO3 (1066.0754384)

(21Z,24Z)-N-[(E)-1,3-dihydroxytriacont-4-en-2-yl]dotetraconta-21,24-dienamide

C72H139NO3 (1066.0754384)

(24Z,27Z,30Z)-N-(1,3-dihydroxytetratriacontan-2-yl)octatriaconta-24,27,30-trienamide

C72H139NO3 (1066.0754384)

(27Z,30Z)-N-[(E)-1,3-dihydroxytetratriacont-4-en-2-yl]octatriaconta-27,30-dienamide

C72H139NO3 (1066.0754384)

(1s,2s,20s,42s,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(3s,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1s,2s,20s,42s,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(3s,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42s,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4s,5s)-2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42s,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4s,5s)-2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-(2,3,4,5-tetrahydroxyoxan-2-yl)-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-(2,3,4,5-tetrahydroxyoxan-2-yl)-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(3r,4s)-2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(3r,4s)-2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42r,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3s,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42r,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3s,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20s,42s,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20s,42s,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3s,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3s,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42r,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3r,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42r,46s)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3r,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[2,3,4-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3r,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2s,3r,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)

(1r,2r,20r,42r,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

(1r,2r,20r,42r,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37-pentadecahydroxy-46-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-3,18,21,41,43-pentaoxanonacyclo[27.13.3.1³⁸,⁴².0²,²⁰.0⁵,¹⁰.0¹¹,¹⁶.0²³,²⁸.0³³,⁴⁵.0³⁴,³⁹]hexatetraconta-5,7,9,11(16),12,14,23,25,27,29,31,33(45),34(39),35,37-pentadecaene-4,17,22,40,44-pentone

C46H34O30 (1066.1134864)