LMPK12113278
  LIPID_MAPS_STRUCTURE_DATABASE

 31 33  0  0  0  0  0  0  0  0999 V2000
    5.8446    7.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8446    6.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4841    6.2265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1236    6.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1236    7.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4841    7.7033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7630    6.2266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4024    6.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4024    7.3341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7629    7.7033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7630    5.4882    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0418    7.7033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6934    7.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3451    7.7033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3451    8.4558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6934    8.8321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0418    8.4558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0540    6.2196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0540    5.0702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9967    8.8320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9922    8.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4841    8.4557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4794    9.0304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9967    7.3271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9967    6.1777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4841    5.4741    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3053    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    7.7103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    8.8596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6934    9.5845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6889   10.1592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  0  0  0  0
 28 29  1  0  0  0  0
 30 31  1  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
  3 26  1  0  0  0  0
  1 28  1  0  0  0  0
 16 30  1  0  0  0  0
  8 18  1  0  0  0  0
 15 20  1  0  0  0  0
  6 22  1  0  0  0  0
 14 24  1  0  0  0  0
M  END
> <LM_ID>
LMPK12113278

> <COMMON_NAME>
Hibiscetin heptamethyl ether

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H24O9

> <MASS>
432.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AFQWYRUBZJYCIF-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C22H24O9/c1-24-12-10-15(27-4)20(29-6)21-16(12)17(23)22(30-7)18(31-21)11-8-13(25-2)19(28-5)14(9-11)26-3/h8-10H,1-7H3

> <SMILES>
C1(OC)=C(OC)C2OC(C3C=C(OC)C(OC)=C(OC)C=3)=C(OC)C(=O)C=2C(OC)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
182687

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5318050

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$