Mol:FL5FGANS0003

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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   -2.5983   -0.3996
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   -1.0494    1.0455
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    0.5403   -0.6973
S  SKP  8
ID	FL5FGANS0003
KNApSAcK_ID	C00004668
NAME	Sarothrin
CAS_RN	57393-71-2
FORMULA	C18H16O8
EXACTMASS	360.08451748799996
AVERAGEMASS	360.31484
SMILES	c(C(O2)=C(C(c(c3O)c2c(c(c3OC)O)OC)=O)OC)(c1)ccc(O)c1
M  END

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