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Mol:FL5FAAGS0022 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
42 46 0 0 0 0 0 0 0 0999 V2000<br />
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36 41 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 41 42<br />
M SBL 1 1 45<br />
M SMT 1 CH2OH<br />
M SVB 1 45 3.0028 -1.4895<br />
S SKP 8<br />
ID FL5FAAGS0022<br />
KNApSAcK_ID C00005172<br />
NAME Multiflorin B<br />
CAS_RN 52657-01-9<br />
FORMULA C27H30O15<br />
EXACTMASS 594.15847029<br />
AVERAGEMASS 594.5181<br />
SMILES c(O)(c5)cc(c(c35)C(=O)C(=C(c(c4)ccc(c4)O)O3)O[C@@H](O1)[C@@H](O)[C@H](O)[C@H](O[C@@H](O2)[C@H](O)[C@H](O)[C@@H](C2CO)O)C(C)1)O<br />
M END<br />
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