CDK     1030232203

 20 20  0  0  0  0  0  0  0  0999 V2000
    0.7144    0.0000    0.0000 O   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
   -0.7144    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7144    0.8250    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.7144   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.2375    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4290    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290   -1.2375    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7144    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.6500    0.0000 O   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
    0.7144    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    0.8250    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1434    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4290    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  2  4  1  0  0  0  0 
  5  3  1  0  0  0  0 
  4  6  2  3  0  0  0 
  7  5  1  0  0  0  0 
  5  8  1  1  0  0  0 
  9  6  1  0  0  0  0 
  7 10  1  1  0  0  0 
  7 11  1  0  0  0  0 
  9 12  1  6  0  0  0 
  9 13  1  0  0  0  0 
 11 14  2  3  0  0  0 
 13 15  1  0  0  0  0 
 14 16  1  0  0  0  0 
 17 15  1  0  0  0  0 
 16 18  2  0  0  0  0 
 16 19  1  0  0  0  0 
 17 20  1  6  0  0  0 
 17 19  1  0  0  0  0 
M  END
> <ID>
CHEBI:226621

> <NAME>
Cordybislactone

> <STAR>
2

> <IUPAC_NAME>
(5R,6S,11S,14R)-5,11-dihydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione

> <FORMULA>
C14H20O6

> <MASS>
284.308

> <MONOISOTOPIC_MASS>
284.12599

> <CHARGE>
0

> <SMILES>
O=C1O[C@H]([C@H](O)C=CC(=O)O[C@@H](CC[C@@H](C=C1)O)C)C

> <INCHI>
InChI=1S/C14H20O6/c1-9-3-4-11(15)5-7-14(18)20-10(2)12(16)6-8-13(17)19-9/h5-12,15-16H,3-4H2,1-2H3/t9-,10+,11+,12-/m1/s1

> <INCHIKEY>
SSVNIYICRYPPEB-NOOOWODRSA-N

$$$$