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Table 3 Likely identity and structural formula deduced for each peak

From: Genetic engineering of the precursor supply pathway for the overproduction of the nC14-surfactin isoform with promising MEOR applications

Number

m/z

Molecular formula

Speculated structure

1

980.63

([C49H85N7O13] + H)+

C12[Leu/Ile2, Val4, Val7] or C13[Val2, Val4, Val7]

2

994.64

([C50H87N7O13] + H)+

C13[Leu/Ile2, Val4, Val7] or C12[Leu/Ile2, Val4, Leu/Ile7]

3

1008.66

([C51H89N7O13] + H)+

C13[Leu/Ile 2, Val4, Leu/Ile 7]

4

994.64

([C50H87N7O13] + H)+

C13[Leu/Ile 2, Val4, Val7]

5

1022.67

([C52H91N7O13] + H)+

C14[Leu/Ile 2, Val4, Val7]

6

1022.67

([C52H91N7O13] + H)+

C14[Leu/Ile 2, Val4, Val7]

7

1036.69

([C53H93N7O13] + H)+

C15[Leu/Ile 2, Val4, Leu/Ile 7]

8

1036.69

([C53H93N7O13] + H)+

C15[Leu/Ile 2, Val4, Leu/Ile 7]

9

1050.70

([C54H95N7O13] + H)+

C15[Leu/Ile 2, Leu/Ile 4, Leu/Ile 7]