Mol:FLIDHXNF0007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 28 33  0  0  0  0  0  0  0  0999 V2000 
   -1.5380    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.5380    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9817   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4254    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4254    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.9817    1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1309   -0.1273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6872    0.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6872    0.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1309    1.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2433   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2433   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8381   -1.1574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4328   -0.8140    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4328   -0.1272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8381    0.2162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1326   -0.8138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2433    0.5149    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0860   -1.0262    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4897   -0.4706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0860    0.0850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1490    1.0347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5265    0.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1490   -0.0046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1687    0.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4897   -0.0411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4897    1.0711    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.1687   -0.5972    0.0000 O   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  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  8 11  1  0  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  1  0  0  0  0 
 12 17  1  0  0  0  0 
  8 18  1  0  0  0  0 
 14 19  1  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  1  0  0  0  0 
 21 15  1  0  0  0  0 
  1 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 24  2  1  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 
 26 28  1  0  0  0  0 
S  SKP  8 
ID	FLIDHXNF0007 
KNApSAcK_ID	C00010023 
NAME	Hildecarpidin 
CAS_RN	111010-27-6 
FORMULA	C21H18O7 
EXACTMASS	382.10525293 
AVERAGEMASS	382.36342 
SMILES	c(c23)c(c1cc2OCC(O)(c45)C3Oc4cc(O6)c(OC6)c5)CC(C(=C)CO)O1 
M  END