Mol:FL5FF9NI0006

From Metabolomics.JP
Jump to: navigation, search

FL5FF9NI0006.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 30  0  0  0  0  0  0  0  0999 V2000 
    1.4289    0.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289   -0.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434   -1.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579   -0.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8579    0.2337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434    0.6462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145   -1.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -0.5913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7145   -1.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7145   -1.8288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -2.2413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.7145   -1.8288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289   -0.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1434   -1.0038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1434   -1.8288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289   -2.2413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0000   -3.0663    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8579   -0.5913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.4289   -2.2413    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4289   -3.0663    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4454    0.6132    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1434   -1.8288    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1006    0.9914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.7837    0.5970    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1006    1.8141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4502    2.1896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8203    2.2296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.8203    3.0663    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 
  2  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12  7  2  0  0  0  0 
  9 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 10  1  0  0  0  0 
 14 18  1  0  0  0  0 
 11 17  2  0  0  0  0 
 12 19  1  0  0  0  0 
 16 20  1  0  0  0  0 
 13 21  1  0  0  0  0 
 19 22  1  0  0  0  0 
 21 23  1  0  0  0  0 
 23 24  2  0  0  0  0 
 23 25  1  0  0  0  0 
 25 26  1  0  0  0  0 
 25 27  2  0  0  0  0 
 27 28  1  0  0  0  0 
S  SKP  8 
ID	FL5FF9NI0006 
KNApSAcK_ID	C00013547 
NAME	5,7,8-Trihydroxy-3-methoxyflavone 8-((E)-2-methylbut-2-enoate);(2E)-5,7-Dihydroxy-3-methoxy-4-oxo-2-phenyl-4H-1-benzopyran-8-yl ester 2-methyl-2-butenoic acid 
CAS_RN	221231-14-7 
FORMULA	C21H18O7 
EXACTMASS	382.10525293 
AVERAGEMASS	382.36342 
SMILES	COC(C3=O)=C(Oc(c23)c(OC(=O)C(C)=CC)c(O)cc2O)c(c1)cccc1 
M  END
Personal tools
Namespaces

Variants
Actions
Navigation
metabolites
Toolbox