Mol:FL5FADNI0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 35  0  0  0  0  0  0  0  0999 V2000 
   -0.1857   -1.1599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.1809   -0.3349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5013   -1.5768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2326   -1.1867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2536   -0.3526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5359    0.0734    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6476   -0.3525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9506    0.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8683    0.0820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6009   -0.3109    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6129   -1.1548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9190   -1.5685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3916    0.0856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3730    0.9371    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6535    1.3338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9726    0.9272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9057   -2.3932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5146   -2.4013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9536   -1.5876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.3219    0.0900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0907    1.3439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8683    0.7513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5828    1.1638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5828    1.9888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2972    2.4013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8683    2.4013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2526   -1.5242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8913   -1.1554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5633   -1.5433    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5633   -2.2194    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.0907   -1.2389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0854   -0.3149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0854   -1.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  1  3  1  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  2  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  5  1  0  0  0  0 
  2  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12  1  2  0  0  0  0 
  7 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  8  2  0  0  0  0 
 12 17  1  0  0  0  0 
  3 18  2  0  0  0  0 
  4 19  1  0  0  0  0 
 10 20  1  0  0  0  0 
 21 14  1  0  0  0  0 
  9 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  2  0  0  0  0 
 24 25  1  0  0  0  0 
 24 26  1  0  0  0  0 
 11 27  1  0  0  0  0 
 27 28  1  0  0  0  0 
 28 29  2  0  0  0  0 
 29 30  1  0  0  0  0 
 29 31  1  0  0  0  0 
 13 32  1  0  0  0  0 
 32 33  1  0  0  0  0 
S  SKP  8 
ID	FL5FADNI0002 
KNApSAcK_ID	C00013525 
NAME	Dorsmanin D;3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-6,8-bis(3-methyl-2-butenyl)-4H-1-benzopyran-4-one 
CAS_RN	211255-16-2 
FORMULA	C26H28O7 
EXACTMASS	452.18350325 
AVERAGEMASS	452.49631999999997 
SMILES	C(=C(C)C)Cc(c1O)c(O)c(C3=O)c(OC(=C3O)c(c2)cc(OC)c(O)c2)c1CC=C(C)C 
M  END