Mol:FL5FFGNS0002

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Copyright: ARM project http://www.metabolome.jp/
 27 29  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  26  27
M  SBL   3  1  28
M  SMT   3  OCH3
M  SVB   3 28    2.0624     1.127
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  24  25
M  SBL   2  1  26
M  SMT   2  OCH3
M  SVB   2 26    0.0044   -1.0246
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  22  23
M  SBL   1  1  24
M  SMT   1  OCH3
M  SVB   1 24   -2.7769    0.4428
S  SKP  8
ID	FL5FFGNS0002
KNApSAcK_ID	C00004842
NAME	Hibiscetin 3,7,4'-trimethyl ether
CAS_RN	71149-61-6
FORMULA	C18H16O9
EXACTMASS	376.07943210999997
AVERAGEMASS	376.31424
SMILES	c(OC)(c(O)1)c(O)cc(C(O2)=C(C(c(c(O)3)c2c(c(OC)c3)O)=O)OC)c1
M  END

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