Ketcher 06151715512D 1   1.00000     0.00000     0

 16 15  0     0  0            999 V2000
   11.2410   -6.5422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2410   -5.5422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5090   -5.5422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3749   -5.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1071   -5.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9730   -5.5422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6429   -5.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3751   -7.0422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8391   -4.0422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7051   -5.5422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7769   -5.5422    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
    9.5090   -6.5422    0.0000 R#  0  0  0  0  0  0  0  0  0  0  0  0
    8.6429   -4.0422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3751   -8.0422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8391   -5.0422    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   13.8391   -6.0422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  8  1  1  0     0  0
  1  2  1  0     0  0
  7  3  1  0     0  0
  4  3  1  0     0  0
  2  4  1  0     0  0
  5  2  1  0     0  0
  6  5  1  0     0  0
  6 15  1  0     0  0
 13  7  2  0     0  0
 11  7  1  0     0  0
 12  8  1  0     0  0
 14  8  2  0     0  0
  9 15  2  0     0  0
 10 15  1  0     0  0
 15 16  1  0     0  0
M  END
> <ID>
CHEBI:134236

> <NAME>
phosphatidic acid (16:0/18:1)

> <DEFINITION>
A phosphatidic acid in which one acyl group has 16 carbons and is fully saturated while the other has 18 carbons and 1 double bond.

> <STAR>
3

> <SYNONYM>
phosphatidic acid (34:1); PA(34:1); PA(16:0/18:1)

> <FORMULA>
C37H71O8P

> <MASS>
226.078

> <MONOISOTOPIC_MASS>
674.48866

> <CHARGE>
0

> <SMILES>
O(C(*)=O)C(COC(=O)*)COP(=O)(O)O

> <PUBMED_CITATION>
24519824; 24813932

$$$$