Retention times, molecular weights, and MS data for metabolites of CB in RLM

Peak No.tRaMol. Wt.IdentificationMolecular Ions (ESI+, m/z)
min
15.28416Monohydroxyl-deacetylcinobufagin417 [M + H]+
458 [M + CH3CN + H]+
25.404143-Ketohydroxyl-deacetylcinobufagin415 [M + H]+
456 [M + CH3CN + H]+
35.61416Monohydroxyl-deacetylcinobufagin417 [M + H]+
458 [M + CH3CN + H]+
46.9540016-Deacetylcinobufagin401 [M + H]+
442 [M + CH3CN + H]+
57.354581α-Hydroxylcinobufagin459 [M + H]+
500 [M + CH3CN + H]+
67.604585β-Hydroxylcinobufagin459 [M + H]+
500 [M + CH3CN + H]+
78.324003-epi-Deacetylcinobufagin401 [M + H]+
442 [M + CH3CN + H]+
810.594423-epi-Cinobufagin443 [M + H]+
484 [M + CH3CN + H]+
  • tR, retention time.