Ketcher 06112413322D 1   1.00000     0.00000     0

 26 27  0     1  0            999 V2000
    1.6556    1.2733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7601    0.2787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9511   -0.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9511   -1.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5878   -0.8090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2079    0.9781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.9563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5878    2.7653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0813    3.5084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4538    3.2653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4484    3.3698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3994    3.0608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1426    2.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9516    2.9795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5492    1.4782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5492    0.4782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1426   -0.4354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3994   -1.1045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4483   -1.4136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4538   -1.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8994   -1.9706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    0.5000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7957   -1.7872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6736   -0.1279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  3  2  1  6     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  3  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 10 12  2  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 15 17  2  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 22  6  1  0     0  0
 20 23  2  0     0  0
  7 24  1  6     0  0
  6 25  1  1     0  0
  2 26  1  0     0  0
M  END
> <ID>
CHEBI:231561

> <NAME>
sesterviolene G

> <DEFINITION>
A sesterterpene that is produced by a sesterterpene synthase from Streptomyces violens

> <STAR>
2

> <FORMULA>
C25H40

> <MASS>
340.595

> <MONOISOTOPIC_MASS>
340.31300

> <CHARGE>
0

> <SMILES>
CC([C@@H]1CC[C@]2([C@]1(CCC(C)=CCCC(C)=CCCC(C=C2)=C)[H])C)C

> <INCHI>
InChI=1S/C25H40/c1-19(2)23-16-18-25(6)17-15-22(5)12-8-10-20(3)9-7-11-21(4)13-14-24(23)25/h10-11,15,17,19,23-24H,5,7-9,12-14,16,18H2,1-4,6H3/b17-15-,20-10-,21-11-/t23-,24-,25-/m0/s1

> <INCHIKEY>
ZOFLFLLHVFTRDR-LNHQKRKUSA-N

> <PUBMED_CITATION>
36350768

$$$$