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Mol:FL5FAAGL0015 - Revision history
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<p><b>New page</b></p><div><pre><br />
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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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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 4.9001 -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 -3.5385 0.6345<br />
S SKP 8<br />
ID FL5FAAGL0015<br />
KNApSAcK_ID C00005182<br />
NAME Kaempferol 3,7-diglucoside<br />
CAS_RN 25615-14-9<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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