Mol:FL5FECNS0022

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Copyright: ARM project http://www.metabolome.jp/
 26 28  0  0  0  0  0  0  0  0999 V2000
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M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  25  26
M  SBL   3  1  27
M  SMT   3  OCH3
M  SVB   3 27   -2.9555   -0.7269
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  23  24
M  SBL   2  1  25
M  SMT   2  OCH3
M  SVB   2 25     2.241     1.127
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  23
M  SMT   1  OCH3
M  SVB   1 23   -2.5983    0.4428
S  SKP  8
ID	FL5FECNS0022
KNApSAcK_ID	C00004698
NAME	Eupatin
CAS_RN	19587-65-6
FORMULA	C18H16O8
EXACTMASS	360.08451748799996
AVERAGEMASS	360.31484
SMILES	c(c1OC)c(O2)c(C(C(=C2c(c3)cc(O)c(OC)c3)O)=O)c(c1OC)O
M  END

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