Mol:FL2FA9NI0023

From Metabolomics.JP
Jump to: navigation, search

FL2FA9NI0023.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
   -1.5338   -0.3928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5152   -1.1966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7381   -1.5818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0832   -1.1808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0690   -0.3559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7947    0.0692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6717   -1.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3455   -1.2053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3363   -0.3389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6524    0.0443    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0508    0.0736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7419   -0.3129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4532    0.0856    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4737    0.9103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7619    1.3401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0416    0.9399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6717   -2.4312    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.2482    0.0197    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7381   -2.4064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7619    2.2234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1075   -0.2922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7947    0.9374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4748    1.3300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4748    2.0254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8279    2.3988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1777    2.4312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1671   -1.5730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8342   -1.1879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4961   -1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4961   -2.3147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.1075   -1.2170    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 
  3 19  1  0  0  0  0 
 15 20  1  0  0  0  0 
 13 21  1  0  0  0  0 
  6 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 
  2 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 
S  SKP  8 
ID	FL2FA9NI0023 
KNApSAcK_ID	C00014177 
NAME	Monotesone B;5,7,3',5'-Tetrahydroxy-6,8-diprenylflavanone 
CAS_RN	208596-56-9 
FORMULA	C25H28O6 
EXACTMASS	424.188588628 
AVERAGEMASS	424.48622 
SMILES	O=C(C2)c(c(OC2c(c3)cc(O)cc(O)3)1)c(O)c(CC=C(C)C)c(c(CC=C(C)C)1)O 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox