LMPK12110932
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0  0  0  0  0  0  0  0999 V2000
    6.2734    8.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2734    7.4999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9925    7.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7115    7.4999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7115    8.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9925    8.7452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4305    7.0847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1495    7.4999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1495    8.3301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4305    8.7452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4305    6.4373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8683    8.7451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6012    8.3219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3339    8.7451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3339    9.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6012   10.0143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8683    9.5913    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9976    9.8947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9925    6.2548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    8.7452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6012    7.4760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8683    7.0848    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.8545    6.2550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5663    5.8281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5525    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2902    6.2302    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9925    9.5751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2737    9.9902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2737   10.8201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5549   11.2351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9925   11.2351    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  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
 18 15  1  0  0  0  0
  3 19  1  0  0  0  0
  1 20  1  0  0  0  0
 13 21  1  0  0  0  0
  8 22  1  0  0  0  0
 22 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
  6 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  2  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110932

> <COMMON_NAME>
Cyclomulberrin

> <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>
SYFDWXWLRGHYAJ-UHFFFAOYSA-N

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

> <SMILES>
C1(O)=C(C/C=C(\C)/C)C2OC3C4C=CC(O)=CC=4OC(/C=C(\C)/C)C=3C(=O)C=2C(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0030688

> <CHEBI_ID>
132869

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11742872

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$