Mol:FLIHFCNF0001

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  30  31
M  SBL   2  1  34
M  SMT   2  OCH3
M  SVB   2 34   -1.4182   -0.5744
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  28  29
M  SBL   1  1  32
M  SMT   1  OCH3
M  SVB   1 32   -0.7037    1.4439
S  SKP  8
ID	FLIHFCNF0001
KNApSAcK_ID	C00010044
NAME	Thonningine A
CAS_RN	86989-16-4
FORMULA	C23H18O8
EXACTMASS	422.100167552
AVERAGEMASS	422.38422
SMILES	O(c(c21)c(C(O)=3)c(OC(=O)C3c(c5)ccc(c54)OCO4)c(c(oc(C(C)=C)c2)1)OC)C
M  END

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