LMPK12111423
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0  0  0  0  0  0  0  0999 V2000
    6.7692    6.8895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7692    6.1412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4172    5.7672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0651    6.1412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0651    6.8895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4172    7.2635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7131    5.7672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610    6.1412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610    6.8895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7131    7.2635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0090    7.2636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6957    6.8671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3823    7.2636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3823    8.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6957    8.4530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0090    8.0565    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7131    5.0190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4172    5.0190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610    8.4306    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1212    5.7672    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1212    7.2636    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1212    8.5582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6957    6.1188    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6207    5.5849    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4172    8.0117    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5385    8.6591    0.0000 C   0  0  0  0  0  0  0  0  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
  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
  9 11  1  0  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
  3 18  1  0  0  0  0
 16 19  1  0  0  0  0
  2 20  1  0  0  0  0
  1 22  1  0  0  0  0
 12 24  1  0  0  0  0
  6 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111423

> <COMMON_NAME>
Skullcapflavone II

> <SYSTEMATIC_NAME>


> <FORMULA>
C19H18O8

> <MASS>
374.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Neobaicalein

> <INCHI_KEY>
GMQFOKBGMKVUQZ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H18O8/c1-23-11-7-5-6-9(20)13(11)12-8-10(21)14-15(22)17(24-2)19(26-4)18(25-3)16(14)27-12/h5-8,20,22H,1-4H3

> <SMILES>
C1(OC)=C(OC)C2OC(C3C(O)=CC=CC=3OC)=CC(=O)C=2C(O)=C1OC

> <KEGG_ID>
C10183

> <HMDB_ID>
-

> <CHEBI_ID>
9061

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
124211

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$