View source for Mol:EEL3010

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 61 60  0  0  0  0  0  0  0  0999 V2000 
   -3.4299   -1.9557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6403   -2.8736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.9323   -2.8845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -6.5936    1.0769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -6.0306    2.1830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -6.3554    3.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.6000    3.8698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.8761    2.0190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -5.3700    2.9744    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.7327    3.4009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.0182    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3041    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5897    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8753    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1609    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4465    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2678    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.9823    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6967    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4110    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1255    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8397    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5541    3.8587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.2685    3.4463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.0419    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.4076    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6933    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9791    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2647    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5503    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1640    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8785    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5929    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3074    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0217    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7359    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4503    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1648    1.9504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.8792    1.5380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.3041    2.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.4465    2.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4110    2.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.2685    2.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6933    0.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.1640    0.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0217    0.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.8792    0.6958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.9829    3.8588    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.5936    1.9505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.8669   -2.8845    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.8669   -1.8994    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.8669   -3.8698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.7216   -2.8845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6449   -1.9604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.6448   -1.0630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8597   -1.9557    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.6194   -1.0744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5058   -1.0631    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5058   -0.0535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.5058   -2.0725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.5037   -1.0631    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  3  4  1  0 
  4  5  1  0 
  5  6  1  0 
  6  7  1  0 
  5  9  1  0 
  5  8  1  0 
 10  7  1  0 
 11 10  1  0 
 12 11  1  0 
 13 12  1  0 
 14 13  1  0 
 15 14  1  0 
 16 15  1  0 
 17 16  1  0 
 18 17  1  0 
 19 18  1  0 
 20 19  1  0 
 21 20  1  0 
 22 21  1  0 
 23 22  1  0 
 24 23  1  0 
 26 25  1  0 
 27 26  1  0 
 28 27  1  0 
 29 28  1  0 
 30 29  1  0 
 31 30  1  0 
 32 31  1  0 
 33 32  1  0 
 34 33  1  0 
 35 34  1  0 
 36 35  1  0 
 37 36  1  0 
 38 37  1  0 
 39 38  1  0 
  8 25  1  0 
 12 40  1  0 
 16 41  1  0 
 20 42  1  0 
 24 43  1  0 
 27 44  1  0 
 31 45  1  0 
 35 46  1  0 
 39 47  1  0 
 24 48  1  0 
 39 49  1  0 
  3 50  1  0 
 50 51  2  0 
 50 52  1  0 
 50 53  1  0 
  2 53  1  0 
  2 54  1  0 
 54 55  1  0 
  1 54  1  0 
 54 56  1  0 
 55 57  1  0 
 59 58  2  0 
 60 58  1  0 
 61 58  1  0 
 57 58  1  0 
S  SKP  6 
ID	EEL3010 
FORMULA	C46H96O11P2 
EXACTMASS	886.6427869339999 
AVERAGEMASS	887.195362 
SMILES	C(CCCC(CCCC(CCCC(C)CCOCC(OCCC(C)CCCC(C)CCCC(C)CCCC(C)C)(COP(OCC(COP(O)(O)=O)([H])O)(O)=O)[H])C)C)(C)C 
AUTODRAW	FALSE 
M  END