13942546
  CDK     1202211637

 33 35  0  0  0  0  0  0  0  0999 V2000
    7.4202   -0.2246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5079   -0.2445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9778   -1.0782    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9778    2.2789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8492    1.4254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4202    2.2504    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5636   -2.2871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9925   -1.4621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7058    1.0129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7058    0.1879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1347    0.1879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9682   -0.2532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9682    1.4540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4202    1.4254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1347    1.0129    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2208    0.1707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8492   -0.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2208    1.0300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8492   -1.0496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5636    0.1879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5636   -1.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2781   -1.0496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2781   -0.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7918    0.1652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0789   -0.2501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2681   -1.4989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2681    2.6996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8492    2.2504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3629    0.1596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500   -0.2556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3597    0.9846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2781   -2.6996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7071   -1.0496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0 
  1 11  1  0  0  0  0 
  2 16  1  0  0  0  0 
  2 24  1  0  0  0  0 
  3 12  1  0  0  0  0 
  3 26  1  0  0  0  0 
  4 13  1  0  0  0  0 
  4 27  1  0  0  0  0 
  5 15  1  0  0  0  0 
  5 28  1  0  0  0  0 
  6 14  2  0  0  0  0 
  7 21  1  0  0  0  0 
  7 32  1  0  0  0  0 
  8 22  1  0  0  0  0 
  8 33  1  0  0  0  0 
  9 10  2  0  0  0  0 
  9 13  1  0  0  0  0 
  9 14  1  0  0  0  0 
 10 12  1  0  0  0  0 
 11 15  2  0  0  0  0 
 11 17  1  0  0  0  0 
 12 16  2  0  0  0  0 
 13 18  2  0  0  0  0 
 14 15  1  0  0  0  0 
 16 18  1  0  0  0  0 
 17 19  2  0  0  0  0 
 17 20  1  0  0  0  0 
 19 21  1  0  0  0  0 
 20 23  2  0  0  0  0 
 21 22  2  0  0  0  0 
 22 23  1  0  0  0  0 
 24 25  1  0  0  0  0 
 25 29  2  0  0  0  0 
 29 30  1  0  0  0  0 
 29 31  1  0  0  0  0 
M  END
> <ID>
CHEBI:186109

> <NAME>
3,5,8,3',4'-Pentamethoxy-7-prenyloxyflavone

> <STAR>
2

> <IUPAC_NAME>
2-(3,4-dimethoxyphenyl)-3,5,8-trimethoxy-7-(3-methylbut-2-enoxy)chromen-4-one

> <FORMULA>
C25H28O8

> <MASS>
456.491

> <MONOISOTOPIC_MASS>
456.17842

> <CHARGE>
0

> <SMILES>
O1C2=C(C(OC)=CC(OCC=C(C)C)=C2OC)C(=O)C(OC)=C1C3=CC(OC)=C(OC)C=C3

> <INCHI>
InChI=1S/C25H28O8/c1-14(2)10-11-32-19-13-18(29-5)20-21(26)25(31-7)22(33-24(20)23(19)30-6)15-8-9-16(27-3)17(12-15)28-4/h8-10,12-13H,11H2,1-7H3

> <INCHIKEY>
DTMYCAXVEVOVSI-UHFFFAOYSA-N

> <LIPID_MAPS_INSTANCE_ACCESSION>
LMPK12113225

$$$$