LMPK12111564
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0  0  0  0  0  0  0  0999 V2000
    7.1503    6.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1503    6.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8706    5.6486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5910    6.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5910    6.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8706    7.3121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3113    5.6486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0316    6.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0316    6.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3113    7.3121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3113    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7516    7.3119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4858    6.8880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2200    7.3119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2200    8.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4858    8.5835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7516    8.1597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7516    5.6487    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4300    7.3121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7097    6.8962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7097    6.0644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4300    5.6486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1743    7.4317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.7059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8706    8.1435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1506    8.5592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1506    9.3906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4305    9.8064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8706    9.8064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4858    9.4309    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9539    8.5833    0.0000 O   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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  8 18  1  0  0  0  0
  1 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22  2  1  0  0  0  0
 20 23  1  0  0  0  0
 20 24  1  0  0  0  0
  6 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 16 30  1  0  0  0  0
 15 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111564

> <COMMON_NAME>
Macaflavone I

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H24O6

> <MASS>
420.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NRGDUDNBWFMMIW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O6/c1-13(2)5-7-16-22-15(9-10-25(3,4)31-22)11-17-20(28)21(29)23(30-24(16)17)14-6-8-18(26)19(27)12-14/h5-6,8-12,26-27,29H,7H2,1-4H3

> <SMILES>
C12OC(C)(C)C=CC1=CC1C(=O)C(O)=C(C3C=C(O)C(O)=CC=3)OC=1C=2C/C=C(\C)/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
178563

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44258685

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$