LMPK12140727
  LIPID_MAPS_STRUCTURE_DATABASE

 29 31  0  0  0  0  0  0  0  0999 V2000
   10.2147   -7.7672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2376   -8.7575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1951   -9.2322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0020   -8.7380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0195   -7.7218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1254   -7.1980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9322   -9.2623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7623   -8.7683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7510   -7.7008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9084   -7.2287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6313   -7.1926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4828   -7.6688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3592   -7.1778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3845   -6.1615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5075   -5.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6201   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9322  -10.1762    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0992   -6.1704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2492   -7.3089    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3547   -9.2674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5175   -8.7840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6704   -9.2729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6704  -10.1959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9802   -8.8745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1951  -10.1760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9522   -5.6485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9267   -4.6488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7797   -4.1269    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0482   -4.1710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  6  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  6 18  1  0  0  0  0
 19  1  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
  3 25  1  0  0  0  0
 18 26  1  0     0  0
 26 27  2  0     0  0
 27 28  1  0     0  0
 27 29  1  0     0  0
M  END
> <LM_ID>
LMPK12140727

> <COMMON_NAME>
Spinoflavanone B

> <SYSTEMATIC_NAME>
(2S)-5,7-Dihydroxy-6,8-diprenylflavanone

> <FORMULA>
C25H28O4

> <MASS>
392.20

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(2S)-5,7-dihydroxy-6,8-bis(3-methylbut-2-enyl)-2-phenyl-2,3-dihydrochromen-4-one

> <INCHI_KEY>
UXCSTUMJYCXTOV-NRFANRHFSA-N

> <INCHI>
InChI=1S/C25H28O4/c1-15(2)10-12-18-23(27)19(13-11-16(3)4)25-22(24(18)28)20(26)14-21(29-25)17-8-6-5-7-9-17/h5-11,21,27-28H,12-14H2,1-4H3/t21-/m0/s1

> <SMILES>
C1(O)=C(C/C=C(\C)/C)C2O[C@H](C3C=CC=CC=3)CC(=O)C=2C(O)=C1C/C=C(/C)\C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
25775471

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 47097

> <CITATION>
-

$$$$