annotate test-data/Metabolites.dat @ 1:fa183805db31 draft default tip

"planemo upload"
author gmat
date Mon, 04 May 2020 11:38:09 -0400
parents 96f7617b4848
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
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1
fa183805db31 "planemo upload"
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1 name formula charge inchi
fa183805db31 "planemo upload"
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2 Suc C4H4O3 -1 InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)/p-2
fa183805db31 "planemo upload"
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3 Fum C4H3O4 -1 InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/p-2/b2-1+
fa183805db31 "planemo upload"
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4 Mal C4H5O5 -1
fa183805db31 "planemo upload"
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5 Cit C6H7O7 -1
fa183805db31 "planemo upload"
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6 aKG C5H5O5 -1
fa183805db31 "planemo upload"
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7 OA C4H3O5 -1
fa183805db31 "planemo upload"
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8 Asp C4H6NO4 -1
fa183805db31 "planemo upload"
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9 Aco C6HO3 -1
fa183805db31 "planemo upload"
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10 2/3PG C3H6O3 -1
fa183805db31 "planemo upload"
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11 G3P C3H7O3 -1
fa183805db31 "planemo upload"
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12 PEP C3H4O3 -1
fa183805db31 "planemo upload"
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13 E4P C4H8O4 -1
fa183805db31 "planemo upload"
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14 R1P C5H8O4 -1
fa183805db31 "planemo upload"
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15 R5P C5H8O4 -1
fa183805db31 "planemo upload"
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16 G1P C6H10O5 -1
fa183805db31 "planemo upload"
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17 G6P C6H10O5 -1
fa183805db31 "planemo upload"
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18 F1P C6H10O5 -1
fa183805db31 "planemo upload"
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19 F6P C6H10O5 -1
fa183805db31 "planemo upload"
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20 M6P C6H10O5 -1
fa183805db31 "planemo upload"
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21 6PG C6H10O6 -1
fa183805db31 "planemo upload"
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22 S7P C7H11O6 -1
fa183805db31 "planemo upload"
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23 FBP C6H11O8P -1
fa183805db31 "planemo upload"
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24 AMP C10H14N5O4 -1
fa183805db31 "planemo upload"
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25 ADP C10H14N5O4 -1
fa183805db31 "planemo upload"
gmat
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26 ATP C10H16N5O10 -1
fa183805db31 "planemo upload"
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27 CDP C9H15N3O7P -1