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. 2020 Jun 15;12(6):396. doi: 10.3390/toxins12060396

Table 1.

Chemical identification of the components of RIPS fractions by high resolution mass spectrometry, in positive and negative electrospray ionization modes (ESI(+) and ESI(−), respectively).

Entry Precursor Ion m/z Extract Identification Elem. Comp. Diff ppm Comp. Type Ref.
Extract analysis in positive mode ESI(+)
1 191.1171 RI24 N-Methyl-5-hydroxytryptamine C11H14N2O 7.00 Alkaloid [40,41,42,43]
2 391.2497 RI23 Sarmentogenin C23H34O5 3.20 Steroid [44]
3 399.2189 RI18 (5β,12β)-12,14-Dihydroxy-11-oxobufa-3,20,22-trienolide C24H30O5 4.39 Steroid [45,46]
399.2182 RI23 2.63
4 401.2306 RI18 14,15-Epoxy-3,5-dihydroxybufa-20,22-dienolide (marinobufagin) C24H32O5 5.48 Steroid [25,31,47,48]
401.2318 RI23 2.50
5 403.2446 RI23 (3β,5β,16β)-3,5,16-Trihydroxy-bufa-14,20,22-dienolide (Bufogenin B) C24H34O5 9.55 Steroid [49,50]
6 435.2356 RI19 11α,19-Di-hydroxy-telocinobufagin C24H34O7 6.15 Steroid [46,51,52]
433.2266 RI24 9.17
7 440.2167 RI23 Argentinogenin C26H31O6 7.24 Steroid [44,53]
8 445.2609 RI18 Bufotalin C26H36O6 4.24 Steroid [35,44,54,55,56,57]
9 458.2310 RI23 19-Oxo-cinobufagin C26H32O7 1.19 Steroid [36,44]
10 461.2481 RI24 Monohydroxylbufotalin C26H36O7 8.73 Steroid [6]
11 531.2983 RI23 3α,12β,25,26-Tetrahydroxy-7-oxo-5β-cholestane-26-O-sulfate C27H46O8S 1.63 Steroid [44]
12 599.3231 RI23 Cinobufagin-3-hemisuberate C34H46O9 1.82 Steroid [58]
Extract analysis in negative mode ESI(−)
13 433.2266 RI24 11α,19-Di-hydroxy-telocinobufagin (Marinosin) C24H34O7 9.17 Steroid [46,52,53]
14 431.2116 RI19 Marinoic acid (3β-hydroxy-11,12-seco-5β,14β-bufa-20,22-dienolide-11,14-olide-12-oic acid) C24H30O7 3.43 Steroid [59,60]

Comp. type–component type (broad classification). Elem. comp.—elemental composition. RI–Rhinella icterica.