Exact Mass: 1068.0910876

Exact Mass Matches: 1068.0910876

Found 48 metabolites which its exact mass value is equals to given mass value 1068.0910876, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Pterocarinin A

10-[2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-(2,3,4,5-tetrahydroxyoxan-2-yl)-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1,3,5(18),6(11),7,9-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2(7),3,5,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

C46H36O30 (1068.1291356)


Pterocarinin a 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. Pterocarinin a is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Pterocarinin a can be found in cloves, which makes pterocarinin a a potential biomarker for the consumption of this food product.

   
   
   
   
   
   

(Z)-N-[(E)-1,3-dihydroxydotriacont-4-en-2-yl]tetracont-29-enamide

(Z)-N-[(E)-1,3-dihydroxydotriacont-4-en-2-yl]tetracont-29-enamide

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

(31Z,34Z)-N-(1,3-dihydroxytriacontan-2-yl)dotetraconta-31,34-dienamide

(31Z,34Z)-N-(1,3-dihydroxytriacontan-2-yl)dotetraconta-31,34-dienamide

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

(Z)-N-[(E)-1,3-dihydroxytetratriacont-4-en-2-yl]octatriacont-27-enamide

(Z)-N-[(E)-1,3-dihydroxytetratriacont-4-en-2-yl]octatriacont-27-enamide

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

(Z)-N-[(E)-1,3-dihydroxytriacont-4-en-2-yl]dotetracont-31-enamide

(Z)-N-[(E)-1,3-dihydroxytriacont-4-en-2-yl]dotetracont-31-enamide

C72H141NO3 (1068.0910876)


   

(Z)-N-[(E)-1,3-dihydroxyoctacos-4-en-2-yl]tetratetracont-33-enamide

(Z)-N-[(E)-1,3-dihydroxyoctacos-4-en-2-yl]tetratetracont-33-enamide

C72H141NO3 (1068.0910876)


   

(Z)-N-[(E)-1,3-dihydroxyhexatriacont-4-en-2-yl]hexatriacont-25-enamide

(Z)-N-[(E)-1,3-dihydroxyhexatriacont-4-en-2-yl]hexatriacont-25-enamide

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

(Z)-N-[(E)-1,3-dihydroxyoctatriacont-4-en-2-yl]tetratriacont-23-enamide

(Z)-N-[(E)-1,3-dihydroxyoctatriacont-4-en-2-yl]tetratriacont-23-enamide

C72H141NO3 (1068.0910876)


   
   

(Z)-N-[(8E,12E)-1,3,4-trihydroxynonacosa-8,12-dien-2-yl]dotetracont-21-enamide

(Z)-N-[(8E,12E)-1,3,4-trihydroxynonacosa-8,12-dien-2-yl]dotetracont-21-enamide

C71H137NO4 (1068.0547042)


   

(21Z,24Z)-N-[(E)-1,3,4-trihydroxynonacos-8-en-2-yl]dotetraconta-21,24-dienamide

(21Z,24Z)-N-[(E)-1,3,4-trihydroxynonacos-8-en-2-yl]dotetraconta-21,24-dienamide

C71H137NO4 (1068.0547042)


   

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

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

C72H141NO3 (1068.0910876)


   
   
   
   
   
   
   

(Z)-N-[(E)-1,3-dihydroxytriacont-4-en-2-yl]dotetracont-21-enamide

(Z)-N-[(E)-1,3-dihydroxytriacont-4-en-2-yl]dotetracont-21-enamide

C72H141NO3 (1068.0910876)


   

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

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

C72H141NO3 (1068.0910876)


   

(11s,12r)-12-[(14r,15r,19r)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

(11s,12r)-12-[(14r,15r,19r)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2r,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

C46H36O30 (1068.1291356)


   

10-{2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1,3,5(18),6(11),7,9-hexaen-14-yl}-3,4,5,11,16,17,18,21,22,33,34-undecahydroxy-9,24,31-trioxaheptacyclo[24.8.0.0²,⁷.0¹⁴,¹⁹.0²⁰,²⁹.0²³,²⁸.0²⁷,³²]tetratriaconta-1(34),2,4,6,14(19),15,17,20,22,26,28,32-dodecaene-8,13,25,30-tetrone

10-{2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1,3,5(18),6(11),7,9-hexaen-14-yl}-3,4,5,11,16,17,18,21,22,33,34-undecahydroxy-9,24,31-trioxaheptacyclo[24.8.0.0²,⁷.0¹⁴,¹⁹.0²⁰,²⁹.0²³,²⁸.0²⁷,³²]tetratriaconta-1(34),2,4,6,14(19),15,17,20,22,26,28,32-dodecaene-8,13,25,30-tetrone

C48H28O29 (1068.0716238)


   

(10r,11r)-10-[(14s,15s,19r)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1,3,5(18),6(11),7,9-hexaen-14-yl]-3,4,5,11,16,17,18,21,22,33,34-undecahydroxy-9,24,31-trioxaheptacyclo[24.8.0.0²,⁷.0¹⁴,¹⁹.0²⁰,²⁹.0²³,²⁸.0²⁷,³²]tetratriaconta-1(34),2,4,6,14(19),15,17,20,22,26,28,32-dodecaene-8,13,25,30-tetrone

(10r,11r)-10-[(14s,15s,19r)-2,3,4,7,8,9,19-heptahydroxy-12,17-dioxo-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1,3,5(18),6(11),7,9-hexaen-14-yl]-3,4,5,11,16,17,18,21,22,33,34-undecahydroxy-9,24,31-trioxaheptacyclo[24.8.0.0²,⁷.0¹⁴,¹⁹.0²⁰,²⁹.0²³,²⁸.0²⁷,³²]tetratriaconta-1(34),2,4,6,14(19),15,17,20,22,26,28,32-dodecaene-8,13,25,30-tetrone

C48H28O29 (1068.0716238)


   

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37,40-hexadecahydroxy-46-(2,3,4,5-tetrahydroxypentanoyl)-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-4,17,22,44-tetrone

7,8,9,12,13,14,25,26,27,30,31,32,35,36,37,40-hexadecahydroxy-46-(2,3,4,5-tetrahydroxypentanoyl)-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-4,17,22,44-tetrone

C46H36O30 (1068.1291356)


   

(10r,11s)-10-[(14r,15r,19r)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2r,3s,4s)-2,3,4,5-tetrahydroxypentanoyl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,16,17,18-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.3.1.0²,⁷]nonadeca-1(18),2(7),3,5,15(19),16-hexaen-11-yl 3,4,5-trihydroxybenzoate

(10r,11s)-10-[(14r,15r,19r)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2r,3s,4s)-2,3,4,5-tetrahydroxypentanoyl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,16,17,18-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.3.1.0²,⁷]nonadeca-1(18),2(7),3,5,15(19),16-hexaen-11-yl 3,4,5-trihydroxybenzoate

C46H36O30 (1068.1291356)


   

(1r,2r,20r,40s,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37,40-hexadecahydroxy-46-[(2r,3r,4s)-2,3,4,5-tetrahydroxypentanoyl]-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-4,17,22,44-tetrone

(1r,2r,20r,40s,42s,46r)-7,8,9,12,13,14,25,26,27,30,31,32,35,36,37,40-hexadecahydroxy-46-[(2r,3r,4s)-2,3,4,5-tetrahydroxypentanoyl]-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-4,17,22,44-tetrone

C46H36O30 (1068.1291356)


   

12-[2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-(2,3,4,5-tetrahydroxyoxan-2-yl)-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

12-[2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-(2,3,4,5-tetrahydroxyoxan-2-yl)-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

C46H36O30 (1068.1291356)


   

(11r,12r)-12-[(14r,15s,19s)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2s,3s,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

(11r,12r)-12-[(14r,15s,19s)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2s,3s,4s,5r)-2,3,4,5-tetrahydroxyoxan-2-yl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

C46H36O30 (1068.1291356)


   

(11s,12r)-12-[(14r,15s,19s)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2s,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

(11s,12r)-12-[(14r,15s,19s)-2,3,4,7,8,9-hexahydroxy-12,17-dioxo-19-[(2s,3r,4r,5s)-2,3,4,5-tetrahydroxyoxan-2-yl]-13,16-dioxatetracyclo[13.3.1.0⁵,¹⁸.0⁶,¹¹]nonadeca-1(18),2,4,6,8,10-hexaen-14-yl]-3,4,5,17,18,19-hexahydroxy-8,14-dioxo-9,13-dioxatricyclo[13.4.0.0²,⁷]nonadeca-1(15),2,4,6,16,18-hexaen-11-yl 3,4,5-trihydroxybenzoate

C46H36O30 (1068.1291356)