Mol:FL3FEANS0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 22 24  0  0  0  0  0  0  0  0999 V2000
   -1.6890    0.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6890   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1886   -0.7483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6881   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6881    0.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1886    0.4074    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1877   -0.7483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3128   -0.4594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3128    0.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1877    0.4074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8129    0.4072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3432    0.1010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8736    0.4072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8736    1.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3432    1.3258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8129    1.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1877   -1.3255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1892    0.4072    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4035    1.3256    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1886   -1.3258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4035   -0.3356    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3888   -0.1649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  1 18  1  0  0  0  0
 14 19  1  0  0  0  0
  3 20  1  0  0  0  0
  2 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   -2.4035   -0.3356
S  SKP  8
ID	FL3FEANS0001
KNApSAcK_ID	C00001050
NAME	Hispidulin
CAS_RN	1447-88-7
FORMULA	C16H12O6
EXACTMASS	300.063388116
AVERAGEMASS	300.26288
SMILES	COc(c(O)3)c(O)c(C(=O)2)c(c3)OC(=C2)c(c1)ccc(O)c1
M  END

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