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Mol:FL5FAAGL0014 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
43 47 0 0 0 0 0 0 0 0999 V2000<br />
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1 2 1 0 0 0 0<br />
2 3 2 0 0 0 0<br />
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8 9 2 0 0 0 0<br />
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10 5 1 0 0 0 0<br />
7 11 2 0 0 0 0<br />
9 12 1 0 0 0 0<br />
12 13 2 0 0 0 0<br />
13 14 1 0 0 0 0<br />
14 15 2 0 0 0 0<br />
15 16 1 0 0 0 0<br />
16 17 2 0 0 0 0<br />
17 12 1 0 0 0 0<br />
3 18 1 0 0 0 0<br />
1 19 1 0 0 0 0<br />
15 20 1 0 0 0 0<br />
22 23 1 0 0 0 0<br />
23 24 1 1 0 0 0<br />
24 25 1 1 0 0 0<br />
26 25 1 1 0 0 0<br />
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27 22 1 0 0 0 0<br />
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27 29 1 0 0 0 0<br />
26 30 1 0 0 0 0<br />
23 21 1 0 0 0 0<br />
8 21 1 0 0 0 0<br />
31 32 1 1 0 0 0<br />
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34 35 1 0 0 0 0<br />
35 36 1 0 0 0 0<br />
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31 37 1 0 0 0 0<br />
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34 19 1 0 0 0 0<br />
36 40 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
25 42 1 0 0 0 0<br />
42 43 1 0 0 0 0<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 42 43<br />
M SBL 2 1 46<br />
M SMT 2 CH2OH<br />
M SVB 2 46 4.6852 -1.4822<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 40 41<br />
M SBL 1 1 44<br />
M SMT 1 CH2OH<br />
M SVB 1 44 -3.7535 0.6345<br />
S SKP 8<br />
ID FL5FAAGL0014<br />
KNApSAcK_ID C00005181<br />
NAME Kaempferol 3-glucoside-7-galactoside<br />
CAS_RN 99883-42-8<br />
FORMULA C27H30O16<br />
EXACTMASS 610.153384912<br />
AVERAGEMASS 610.5175<br />
SMILES O([C@@H]([C@@H](O)5)OC(CO)[C@H](O)[C@@H]5O)c(c4)cc(c(c41)C(=O)C(O[C@@H](C(O)3)O[C@@H]([C@@H](C(O)3)O)CO)=C(c(c2)ccc(c2)O)O1)O<br />
M END<br />
</pre></div>
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