Mol:FL2FA9NI0018

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FL2FA9NI0018.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 27 30  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
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 26 27  1  0  0  0  0
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  26  27
M  SBL   2  1  29
M  SMT   2  OCH3
M  SVB   2 29   -1.5098   -1.3716
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  24  25
M  SBL   1  1  27
M  SMT   1  OCH3
M  SVB   1 27   -1.9336    0.2995
S  SKP  8
ID	FL2FA9NI0018
KNApSAcK_ID	C00008455
NAME	Epoxycandidone
CAS_RN	109770-91-4
FORMULA	C22H24O5
EXACTMASS	368.162373878
AVERAGEMASS	368.42296000000005
SMILES	C(C(=O)1)C(c(c4)cccc4)Oc(c(CC(O3)C3(C)C)2)c(c(cc(OC)2)OC)1
M  END

</pre>

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