Ketcher 01222016192D 1   1.00000     0.00000     0

 19 18  0     1  0            999 V2000
    8.0420  -10.6405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1762  -10.1418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3098  -10.6405    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4445  -10.1418    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
    8.5422  -11.5062    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5414  -11.5062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9077  -10.1405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7739  -10.6405    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5053  -10.6400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3713  -10.1402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2371  -10.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1030  -10.1402    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5357  -11.5056    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
   10.6395  -10.1405    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   10.6392   -9.1407    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8981  -11.1059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9690  -10.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1028   -9.1404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9688   -9.6402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  1  6  1  6     0  0
  1  5  1  1     0  0
  7  1  1  0     0  0
  8  7  1  0     0  0
 10  9  1  0     0  0
 11 10  1  0     0  0
 12 11  1  0     0  0
  6 13  1  0     0  0
  8 14  1  0     0  0
 14  9  1  0     0  0
 14 15  2  0     0  0
 14 16  1  0     0  0
 12 17  1  0     0  0
 12 18  1  0     0  0
 12 19  1  0     0  0
M  CHG  2  12   1  16  -1
M  RGP  2   4   1  13   2
M  END
> <ID>
CHEBI:64538

> <NAME>
phosphatidylcholine O-36:6

> <DEFINITION>
A glycerophosphocholine that is an alkyl,acyl-sn-glycero-3-phosphocholine in which the alkyl or acyl groups at positions 1 and 2 contain a total of 36 carbons and 6 double bonds.

> <STAR>
3

> <SYNONYM>
phosphatidylcholine(O-36:6); PC(O-36:6); PC O-36:6; GPCho(O-36:6)

> <FORMULA>
C44H78NO7P

> <MASS>
763.55159

> <MONOISOTOPIC_MASS>
763.55159

> <CHARGE>
0

> <SMILES>
[C@](CO*)(O*)([H])COP(OCC[N+](C)(C)C)(=O)[O-]

> <PUBMED_CITATION>
19347970

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