Mol:FL2FAANI0026

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 28  0  0  0  0  0  0  0  0999 V2000 
   -2.4974   -0.4134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4788   -1.2173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7017   -1.6025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0468   -1.2014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.0327   -0.3765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7583    0.0485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2919   -1.6269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3819   -1.2259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.3727   -0.3596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.3112    0.0237    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0872    0.0529    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7782   -0.3335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4896    0.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5101    0.8897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.7983    1.3195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0779    0.9193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2919   -2.3686    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.2119   -0.0009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2119    1.2949    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7017   -2.4526    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7583    0.8026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4728    1.2151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1873    0.8026    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4728    2.0401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7583    2.4526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1873    2.4526    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 
  4  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  5  1  0  0  0  0 
  9 11  1  6  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 
  6 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 22 24  1  0  0  0  0 
 24 25  2  0  0  0  0 
 24 26  1  0  0  0  0 
S  SKP  8 
ID	FL2FAANI0026 
KNApSAcK_ID	C00014198 
NAME	Tomentosanol D;5,7,4'-Trihydroxy-8-(2-hydroxy-3-methylbutyl-3-enyl)flavanone 
CAS_RN	202054-73-7 
FORMULA	C20H20O6 
EXACTMASS	356.125988372 
AVERAGEMASS	356.3692 
SMILES	c(c(CC(O)C(C)=C)3)(c2c(cc(O)3)O)OC(CC(=O)2)c(c1)ccc(O)c1 
M  END