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Mol:FL64DBGM0001 - 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 39 40<br />
M SBL 1 1 43<br />
M SMT 1 OCH3<br />
M SBV 1 43 -8.0568 4.7850<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 41 42<br />
M SBL 2 1 45<br />
M SMT 2 ^CH2OH<br />
M SBV 2 45 -8.0188 5.7297<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 43 44<br />
M SBL 3 1 47<br />
M SMT 3 OCH3<br />
M SBV 3 47 -7.0536 5.2728<br />
M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 45 46<br />
M SBL 4 1 49<br />
M SMT 4 ^CH2OH<br />
M SBV 4 49 -8.0188 5.7297<br />
S SKP 8<br />
ID FL64DBGM0001<br />
KNApSAcK_ID C00008980<br />
NAME Eruberin C<br />
CAS_RN 90146-70-6<br />
FORMULA C31H42O15<br />
EXACTMASS 654.252370674<br />
AVERAGEMASS 654.65618<br />
SMILES C(O)(C(O)1)C(C(Oc(c5C)c(c(c(c53)C(OC)CC(c(c4)ccc(c4)OC)O3)OC(O2)C(C(C(C2CO)O)O)O)C)OC(CO)1)O<br />
M END<br />
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