Ketcher 08052123002D 1   1.00000     0.00000     0

 21 20  0     0  0            999 V2000
   14.9489  -20.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0901  -21.1629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2314  -20.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3726  -21.1629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5139  -20.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6552  -21.1629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7964  -20.6478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9489  -19.6745    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8077  -21.1629    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9209  -21.1336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6749  -20.6622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5423  -21.1629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4095  -20.6622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2769  -21.1629    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
   18.4095  -19.6610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.5423  -22.1644    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.6749  -22.6651    0.0000 *   0  0  0  0  0  0  0  0  0  0  0  0
    8.0536  -20.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1865  -21.1336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3192  -20.6330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4520  -21.1336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  9  1  1  0     0  0
  8  1  2  0     0  0
  3  2  1  0     0  0
  3  4  1  0     0  0
  5  4  1  0     0  0
  5  6  1  0     0  0
  7  6  1  0     0  0
  7 10  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
  9 11  1  0     0  0
 13 15  2  0     0  0
 12 16  1  1     0  0
 16 17  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 10 18  1  0     0  0
M  END
> <ID>
CHEBI:177292

> <NAME>
O-lauroyl-L-serine residue

> <STAR>
2

> <SYNONYM>
O-dodecanoyl-L-serine residue

> <FORMULA>
C15H27NO3

> <MASS>
269.380

> <MONOISOTOPIC_MASS>
269.19909

> <CHARGE>
0

> <SMILES>
C(CCCCCCCCCCC)(OC[C@@H](C(*)=O)N*)=O

> <PUBMED_CITATION>
18443287

$$$$