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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 40 41<br />
M SBL 3 1 44<br />
M SMT 3 CH2OH<br />
M SVB 3 44 -4.5418 -0.8411<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 38 39<br />
M SBL 2 1 42<br />
M SMT 2 CH2OH<br />
M SVB 2 42 -1.6337 -0.3874<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 42 43<br />
M SBL 1 1 46<br />
M SMT 1 OCH3<br />
M SVB 1 46 0.2348 0.897<br />
S SKP 8<br />
ID FL3FCACS0017<br />
KNApSAcK_ID C00006265<br />
NAME Zivulgarin<br />
CAS_RN 108657-24-5<br />
FORMULA C28H32O15<br />
EXACTMASS 608.174120354<br />
AVERAGEMASS 608.54468<br />
SMILES c(c5)c(ccc5O)C(O1)=CC(c(c(O)2)c(cc(OC)c2[C@@H]([C@H]4O)OC([C@@H]([C@@H]4O)O[C@H](O3)[C@H]([C@@H](O)[C@H](C3CO)O)O)CO)1)=O<br />
M END<br />
</pre></div>
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