CDK     1029232201

 18 18  0  0  0  0  0  0  0  0999 V2000
    6.8429    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4304    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2554    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7159   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3034   -1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0014    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1285   -1.1270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2870   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0014    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9849    0.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8580   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1599    0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  1  3  1  0  0  0  0 
  2  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  4  7  1  0  0  0  0 
  6  8  1  0  0  0  0 
  6  9  1  0  0  0  0 
  8 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
 10 13  1  0  0  0  0 
 12 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 17  1  0  0  0  0 
 16 18  1  0  0  0  0 
  2  3  1  0  0  0  0 
M  END
> <ID>
CHEBI:203136

> <NAME>
Viridenepoxydiol

> <STAR>
2

> <IUPAC_NAME>
3,5,9-trimethyl-2-(oxiran-2-yl)dec-8-ene-2,5-diol

> <FORMULA>
C15H28O3

> <MASS>
256.386

> <MONOISOTOPIC_MASS>
256.20384

> <CHARGE>
0

> <SMILES>
O1C(C(O)(C(CC(O)(CCC=C(C)C)C)C)C)C1

> <INCHI>
InChI=1S/C15H28O3/c1-11(2)7-6-8-14(4,16)9-12(3)15(5,17)13-10-18-13/h7,12-13,16-17H,6,8-10H2,1-5H3

> <INCHIKEY>
HBWYIBVXDOPMMA-UHFFFAOYSA-N

$$$$