Table 2: List of identified metabolites in blood plasma samples of PCa patients using NMR spectroscopy and their chemical shift (ppm) positions of resonances 1H of metabolites. Code (identifiers) of the metabolites of data sets was searched in different metabolites Databases (KEGGID and HMDB).

S.No.

Blood plasma Metabolites

Chemical shift δ (1H) ppm

Multiplicity

HMDB

KEGG

1

Leucine

0.96

t

HMDB0000687

C00123

2

Valine

1.00

d

HMDB0000883

C00183

3

Isoleucine

0.94

d

HMDB0000172

C00407

4

3HOB

1.20

d

HMDB0000442

C03197

5

Lactate

1.33

d

HMDB0000190

C00186

6

Alanine

1.48

d

HMDB0000161

C00041

7

Acetate

1.91

s

HMDB0000042

C00033

8

Acetoacetate

2.23

s

HMDB0000060

C00164

9

Glutamate

2.36

m

HMDB0000148

C00025

10

Pyruvate

2.37

s

HMDB0000243

C00022

11

Glutamine

2.45

m

HMDB0000641

C00064

12

DMA

2.73

s

HMDB0000087

C00543

13

Creatine

3.03

s

HMDB0000064

C00300

14

Phosphocreatine

3.05

s

HMDB0001511

C02305

15

Malonate

3.16

s

HMDB0000691

C00383

16

Choline

3.21

s

HMDB0000097

C00114

17

GPC

3.23

s

HMDB0000086

C00670

18

Glycine

3.56

s

HMDB0000123

C00037

19

Creatinine

4.06

s

HMDB0000562

C00791

20

Tyrosine

6.88

d

HMDB0000158

C00082

21

Histidine

7.08

s

HMDB0000177

C00135

22

Phenylalanine

7.33

m

HMDB0000159

C00079

23

Glucose

5.23, 4.64

d

HMDB0000122

C00031

24

Taurine

3.25

s

HMDB0000251

C00245

25

Betaine

3.91

s

HMDB0000043

C00719

3HOB: 3Hyroxybutyrate; DMA: Dimethyl Amine; GPC: Glycerophosphocholine; s: Singlet; d: Doublet, t: Triplet m: Multiplet