Mol:FL5F19NF0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 22 25  0  0  0  0  0  0  0  0999 V2000 
   -1.7189    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.7189   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1626   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6063   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6063    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1626    0.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0500   -0.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5063   -0.5617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5063    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0500    0.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0500   -1.3837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0624    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6293    0.0744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1963    0.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1963    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6293    1.3837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0624    1.0564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2962    1.0301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9350    1.0973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1963    0.5105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3723   -1.0617    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.2384   -1.5616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  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 
  7 11  2  0  0  0  0 
  9 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 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
  6 18  1  0  0  0  0 
 18 19  2  0  0  0  0 
 19 20  1  0  0  0  0 
 20  1  1  0  0  0  0 
  8 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  21  22 
M  SBL   1  1  24 
M  SMT   1  OCH3 
M  SVB   1 24    0.7051    -0.768 
S  SKP  8 
ID	FL5F19NF0001 
KNApSAcK_ID	C00005089 
NAME	Karanjin;3-Methoxy-2-phenyl-4H-Furo[2,3-h]-1-benzopyran-4-one 
CAS_RN	521-88-0 
FORMULA	C18H12O4 
EXACTMASS	292.073558872 
AVERAGEMASS	292.28548 
SMILES	c(C(O4)=C(C(c(c43)ccc(c32)occ2)=O)OC)(c1)cccc1 
M  END