480785
  CDK     0602212310

 31 33  0  0  0  0  0  0  0  0999 V2000
    4.9739   -0.5047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9644    2.0274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1535   -0.0409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219    1.9989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0929   -0.4761    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5729    2.4396    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7214    0.7786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7214   -0.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4343    1.1939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9739    1.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364    0.7614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364   -0.0636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -0.4761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1504    0.7841    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219    1.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8632    1.1994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4311    2.0189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -1.3011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075   -0.0636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075    0.7614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8600    2.0243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1440    2.4341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793    0.7896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075   -1.7136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2921    1.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075   -2.5386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0082    0.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0929   -2.9511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -2.9511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7210    1.2104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0114   -0.0299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0 
  1 12  1  0  0  0  0 
  2 10  2  0  0  0  0 
  3 14  1  0  0  0  0 
  4 15  1  0  0  0  0 
  5 19  1  0  0  0  0 
  6 21  1  0  0  0  0 
  7  8  1  0  0  0  0 
  7  9  1  0  0  0  0 
  7 10  1  0  0  0  0 
  9 14  2  0  0  0  0 
  9 17  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 11 15  2  0  0  0  0 
 12 13  2  0  0  0  0 
 13 18  1  0  0  0  0 
 13 19  1  0  0  0  0 
 14 16  1  0  0  0  0 
 15 20  1  0  0  0  0 
 16 21  2  0  0  0  0 
 16 23  1  0  0  0  0 
 17 22  2  0  0  0  0 
 18 24  1  0  0  0  0 
 19 20  2  0  0  0  0 
 21 22  1  0  0  0  0 
 23 25  1  0  0  0  0 
 24 26  2  0  0  0  0 
 25 27  2  0  0  0  0 
 26 28  1  0  0  0  0 
 26 29  1  0  0  0  0 
 27 30  1  0  0  0  0 
 27 31  1  0  0  0  0 
M  END
> <ID>
CHEBI:173269

> <NAME>
2',4',5,7-Tetrahydroxy-3',8-diprenylisoflavanone

> <STAR>
2

> <IUPAC_NAME>
3-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one

> <FORMULA>
C25H28O6

> <MASS>
424.493

> <MONOISOTOPIC_MASS>
424.18859

> <CHARGE>
0

> <SMILES>
O1CC(C2=C(O)C(=C(O)C=C2)CC=C(C)C)C(=O)C=3C1=C(CC=C(C)C)C(O)=CC3O

> <INCHI>
InChI=1S/C25H28O6/c1-13(2)5-7-16-19(26)10-9-15(23(16)29)18-12-31-25-17(8-6-14(3)4)20(27)11-21(28)22(25)24(18)30/h5-6,9-11,18,26-29H,7-8,12H2,1-4H3

> <INCHIKEY>
FSHPJPOJLGCQOJ-UHFFFAOYSA-N

> <LIPID_MAPS_INSTANCE_ACCESSION>
LMPK12050490

$$$$