Mol:FLIAAANI0006

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 35 37  0  0  0  0  0  0  0  0999 V2000 
   -2.8957    0.9022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8957    0.2599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3394   -0.0613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7831    0.2599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7831    0.9022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3394    1.2234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2268   -0.0613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6705    0.2599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6705    0.9022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2268    1.2234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1144   -0.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1144   -0.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4804   -1.0914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0752   -0.7480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0752   -0.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4804    0.2822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2268   -0.7034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3394   -0.7034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4520    1.2234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6694   -1.0911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6694    0.2819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2636   -0.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8578    0.2819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8578    0.9680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4520   -0.0612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3394    1.8655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8955    2.1866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8955    2.8287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3394    3.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4516    3.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4804   -1.7775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0746   -2.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0746   -2.8067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6688   -3.1498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.4804   -3.1498    0.0000 C   0  0  0  0  0  0  0  0  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 
  8 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 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 11  2  0  0  0  0 
  1  2  1  0  0  0  0 
  7 17  2  0  0  0  0 
  3 18  1  0  0  0  0 
  1 19  1  0  0  0  0 
 14 20  1  0  0  0  0 
 15 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  2  0  0  0  0 
 23 24  1  0  0  0  0 
 23 25  1  0  0  0  0 
  6 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
 27 28  2  0  0  0  0 
 28 29  1  0  0  0  0 
 28 30  1  0  0  0  0 
 13 31  1  0  0  0  0 
 31 32  1  0  0  0  0 
 32 33  2  0  0  0  0 
 33 34  1  0  0  0  0 
 33 35  1  0  0  0  0 
S  SKP  8 
ID	FLIAAANI0006 
KNApSAcK_ID	C00009840 
NAME	Flemiphyllin;5,7,4'-Trihydroxy-8,3',5'-triprenylisoflavone 
CAS_RN	92519-86-3 
FORMULA	C30H34O5 
EXACTMASS	474.240624198 
AVERAGEMASS	474.58796000000007 
SMILES	O=C(C=2c(c3)cc(CC=C(C)C)c(O)c(CC=C(C)C)3)c(c(OC2)1)c(cc(O)c1CC=C(C)C)O 
M  END