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Mol:FL3FABDS0002 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 38 39<br />
M SBL 1 1 42<br />
M SMT 1 CH2OH<br />
M SBV 1 42 -5.2620 5.9293<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 40 41<br />
M SBL 2 1 44<br />
M SMT 2 OCH3<br />
M SBV 2 44 -5.3720 5.8658<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 42 43<br />
M SBL 3 1 46<br />
M SMT 3 ^CH2OH<br />
M SBV 3 46 -6.3563 6.3118<br />
S SKP 8<br />
ID FL3FABDS0002<br />
KNApSAcK_ID C00006279<br />
NAME Cytisoside 7-O-glucoside<br />
CAS_RN 18456-23-0<br />
FORMULA C28H32O15<br />
EXACTMASS 608.174120354<br />
AVERAGEMASS 608.54468<br />
SMILES C(C(O)5)(O)C(O)C(OC(CO)5)c(c12)c(OC(C(O)4)OC(CO)C(O)C4O)cc(O)c1C(=O)C=C(c(c3)ccc(OC)c3)O2<br />
M END<br />
</pre></div>
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