Mol:FL2FFANS0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.8426   -0.4629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3217   -0.7636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8008   -0.4629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8008    0.1385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3217    0.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8426    0.1385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2800   -0.7636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2409   -0.4629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2409    0.1385    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.2800    0.4393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7613    0.4390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2800   -1.2876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2957    0.1305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8300    0.4390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8300    1.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2957    1.3645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7613    1.0560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3635    0.4393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3217   -1.3645    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3635    1.3640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0615    1.0020    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6418    1.9097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  4  1  0  0  0  0
  9 11  1  0  0  0  0
  7 12  2  0  0  0  0
 11 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 11  1  0  0  0  0
  6 18  1  0  0  0  0
  2 19  1  0  0  0  0
 15 20  1  0  0  0  0
  5 21  1  0  0  0  0
 21 22  1  0  0  0  0
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   -1.0615     1.002
S  SKP  8
ID	FL2FFANS0004
KNApSAcK_ID	C00008445
NAME	5,7,4'-Trihydroxy-8-methoxyflavanone
CAS_RN	94884-92-1
FORMULA	C16H14O6
EXACTMASS	302.07903818
AVERAGEMASS	302.27876000000003
SMILES	COc(c(O)3)c(O1)c(c(O)c3)C(=O)CC(c(c2)ccc(O)c2)1
M  END

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