Metabolites

(ppm)

H6C7

Miapaca-2

Panc-1

AsPC-1

AXP

8.61

0.19a (0.056)b

0.03 (0.012)

0.03 (0.013)

0.04 (0.012)

 

-5.60c

-5.91

Acetamide

2.024

**

012 (0.060)

0.08 (0.020)

**

 

***

***

Acetate

1.922

0.06 (0.003)

0.17 (0.053)

0.26 (0.014)

0.19 (0.108)

 

2.8

4.36

3.18

Alanine

1.491

0.24 (0.016)

0.10 (0.034)

0.03 (0.008)

0.23 (0.068)

 

-2.38

-6.97

-1.01

Aspartate

2.67(dd)

0.09 (0.008)

0.12 (0.050)

0.11 (0.023)

0.43 (0.132)

 

1.25

1.15

4.65

Choline

3.209 (s)

0.07 (0.082)

0.08 (0.025)

0.004 (0.0005)

0.35 (0.121)

 

-2.6

-18.3

5.31

Creatine

3.05

0.11 (0.008)

0.01 (0.109)

0.15 (0.048)

0.16 (0.053)

 

-1.03

1.35

1.42

 

3.933

0.11 (0.006)

*

0.16 (0.051)

0.18 (0.063)

 

1.49

1.68

Glutamate

2.061 (m)

0.61 (0.029)

*

0.60 (0.172)

*

 

-1.02

 

2.163-2.129 (m)

0.56 (0.049)

*

0.59 (0.164)

*

 

1.04

 

2.34-2.37 (m)

0.56 (0.050)

0.47 (0.23)

0.52 (0.128)

0.45 (0.149)

 

-1.19

1.08

-1.26

 

3.76(m)

*

0.49 (0.267)

0.51 (0.136)

0.43 (0.14)

 

***

***

Glutamine

2.478-2.422 (m)

1.10 (0.050)

0.18 (0.105)

**

**

 

-6.13

Glutathione

2.58-2.60(m)

**

0.26 (0.137)

**

0.20 (0.047)

 

***

1.2

 

2.973 (dd)

**

0.27 (0.139)

**

*

 

***

 

3.02 (dd)

**

0.28 (0.158)

**

*

 

***

GPC

3.236

0.03 (0.005)

0.08 (0.021)

0.17 (0.047)

0.22 (0.200)

 

1.05

2.69

7.89

Isoleucine

0.944 (t)

0.12 (0.007)

0.07 ( 0.031)

0.07 (0.022)

0.07 (0.022)

 

-1.91

-1.68

-1.72

 

1.011 (d)

0.12 (0.006)

0.05 (0.038)

0.07 (0.024)

0.07 (0.02)

 

-2.19

-1.71

-1.82

Lactate

1.342 (d)

0.81 (0.080)

0.13 (0.009)

0.20 (0.036)

0.21 (0.036)

 

-6.04

-4.1

-3.79

 

4.1 (q)

0.79 (0.079)

0.13 (0.006)

0.20 (0.036)

*

 

-6.16

-4.02

Leucine

0.945(d)

0.13 (0.004)

0.06 (0.028)

0.07 (0.022)

0.07 (0.024)

 

-2.08

-1.82

-1.77

 

0.975(d)

0.13 (0.005)

0.06 (0.027)

0.08 (0.021)

0.07 (0.023)

 

-2.1

-1.9

-1.83

Myo-inositol

4.05 (t)

0.31 (0.015)

0.41 (0.138)

1.04 (0.250)

1.70 (0.567)

 

1.32

3.32

2.06

 

3.6389-3.616 (t)

0.29 (0.023)

0.37 (0.116)

0.98 (0.241)

1.55 (0.474)

 

1.27

3.34

5.28

 

3.551-3.549 (dd)

0.35 (0.028)

0.44 (0.143)

1.13 (0.289)

1.78 (0.560)

 

1.25

3.2

5.02

 

3.287-3.276 (t)

0.35 (0.017)

0.43 (0.139)

1.13 (0.292)

1.70 (0.516)

 

1.23

3.27

4.92

Octanoic acid

0.85(t)

**

0.03 (0.005)

0.05 (0.002)

**

 

***

***

PC

3.226

0.07 (0.006)

0.15 (0.084)

0.01 (0.002)

0.26 (0.088)

 

2.03

-7.15

3.53

Phospho creatine

3.048

0.08 (0.004)

0.03 (0.010)

0.13 (0.025)

0.08 (0.026)

 

-2.63

1.64

1.04

Serine

3.992 (dd)

0.24 (0.026)

**

**

**

 

3.94(dd)

0.24 (0.021)

**

**

**

 

3.84 (dd)

0.22 (0.019)

**

**

**

3-hydroxy-isovalerate

1.255 (s)

0.07 (0.002)

**

**

**

Succinate

2.4 (s)

0.02 (0.002)

0.005 (0.002)

**

0.09 (0.035)

 

-4.65

4.02

Threonie

1.32(d)

0.13 (0.005)

0.13 (0.062)

0.10 (0.034)

0.09 (0.041)

 

1

-1.33

-1.43

 

3.592 (d)

0.11 (0.008)

*

*

*

Valine

0.993 (d)

0.12 (0.005)

0.05 (0.025)

0.06 (0.019)

0.04 (0.012)

 

-2.3

-1.93

-2.85

 

1.043 (d)

0.12 (0.005)

0.05 (0.023)

0.06 (0.019)

0.04 (0.012)

 

-2.33

-1.94

-2.96

 

3.60 (d)

0.12 (0.009)

*

*

*

* overlap
** not detected
*** fold change not reported due to the absence of the metabolite in one group
aconcentration of metabolite (mM)
bstandard deviation of concentration (mM) in parentheses
cfold-change. A negative value indicates that the treatment group concentration was lower than in the control group concentration. In this case, the treatment group
concentration was divided by the control group concentration and then the negative of the inverse of this ratio was reported in the table
.
Table 5: Estimated metabolite concentrations and fold-changes in hydrophilic extracts. Fold-changes were calculated by the treated group concentrations divided by the appropriate control concentrations: H6C7 and Miapaca-2, H6C7 and Panc-1, H6C7 and AsPC-1, Miapaca-2 and Panc-1, Miapaca-2 and AsPC-1, and Panc-1 and AsPC-1.