Mol:LBPR02020007

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 29 30  0  0  0  0  0  0  0  0999 V2000 
   13.2321   -3.7811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.3660   -4.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5000   -3.7811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5000   -2.7811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.3660   -2.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   13.2321   -2.7811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6340   -2.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.6340   -1.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   11.5000   -0.7811    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
   11.0000    0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   10.0000    0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.5000    0.9510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.5000    0.9510    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    8.0000    1.8170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.0000    1.8170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.5000    2.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5000    2.6830    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    5.0000    3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   14.0981   -2.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.0000    1.8170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.0000    0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    8.0000    0.0849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0000    3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5000    4.4151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5000    4.4151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    3.5490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    5.2811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   12.3660   -1.2811    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   12.3660   -5.2811    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 
  1  6  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 28  1  6  0  0  0 
  5 28  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  1  0  0  0  0 
  6 19  1  0  0  0  0 
  2 29  1  0  0  0  0 
 17 20  1  6  0  0  0 
  9 21  1  1  0  0  0 
 13 22  1  6  0  0  0 
 18 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 24 25  1  0  0  0  0 
 25 26  1  0  0  0  0 
 25 27  1  0  0  0  0 
S  SKP  5 
ID	LBPR02020007 
FORMULA	C27H46O2 
EXACTMASS	402.349780716 
AVERAGEMASS	402.65294 
SMILES	C(C[C@](C2)(C)Oc(c(C)1)c(C2)cc(c1)O)C[C@@H](CCC[C@H](C)CCCC(C)C)C 
M  END