15569775
  CDK     0404242200

 19 18  0  0  0  0  0  0  0  0999 V2000
    8.0804   -0.4909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0818    0.7466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3674   -0.4909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3659    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0804    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6515    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9370    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7949    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2224    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5094    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5080    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7935    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2239    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0790    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9383    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3645    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6529    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3674    0.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0 
  2 19  1  0  0  0  0 
  3 19  2  0  0  0  0 
  4  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  5  8  1  0  0  0  0 
  6  7  1  0  0  0  0 
  7  9  1  0  0  0  0 
  8 10  1  0  0  0  0 
  9 11  1  0  0  0  0 
 10 13  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 14  1  0  0  0  0 
 13 15  1  0  0  0  0 
 14 16  1  0  0  0  0 
 15 17  1  0  0  0  0 
 16 18  1  0  0  0  0 
 17 19  1  0  0  0  0 
M  END
> <ID>
CHEBI:230203

> <NAME>
7-Hydroxyhexadecanoic acid

> <STAR>
2

> <IUPAC_NAME>
7-hydroxyhexadecanoic acid

> <FORMULA>
C16H32O3

> <MASS>
272.429

> <MONOISOTOPIC_MASS>
272.23514

> <CHARGE>
0

> <SMILES>
OC(CCCCCCCCC)CCCCCC(O)=O

> <INCHI>
InChI=1S/C16H32O3/c1-2-3-4-5-6-7-9-12-15(17)13-10-8-11-14-16(18)19/h15,17H,2-14H2,1H3,(H,18,19)

> <INCHIKEY>
PHFQJBDKBCFMOS-UHFFFAOYSA-N

$$$$