LMPK12111474
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.5467    8.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5467    7.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3608    7.0006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1749    7.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1749    8.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3608    8.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9891    7.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8031    7.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8031    8.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9891    8.8807    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9891    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6173    8.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4470    8.4016    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2768    8.8807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2768    9.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4470   10.3178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6173    9.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    7.0007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3608    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0910   10.3088    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4470   11.2579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7144   11.9896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    8.8807    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   10.3441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3608    9.8208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6282   10.5525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
 23 24  1  0  0  0  0
 25 26  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
  2 18  1  0  0  0  0
  3 19  1  0  0  0  0
 15 20  1  0  0  0  0
 16 21  1  0  0  0  0
  1 23  1  0  0  0  0
  6 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111474

> <COMMON_NAME>
Thymonin

> <SYSTEMATIC_NAME>
5,6,4'-Trihydroxy-7,8,3'-trimethoxyflavone

> <FORMULA>
C18H16O8

> <MASS>
360.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Mucroflavone B; Majoranin

> <INCHI_KEY>
BAIRXMVFPKLWSE-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O8/c1-23-12-6-8(4-5-9(12)19)11-7-10(20)13-14(21)15(22)17(24-2)18(25-3)16(13)26-11/h4-7,19,21-22H,1-3H3

> <SMILES>
C1(OC)=C(OC)C2OC(C3C=C(OC)C(O)=CC=3)=CC(=O)C=2C(O)=C1O

> <KEGG_ID>
C10191

> <HMDB_ID>
HMDB0037334

> <CHEBI_ID>
9582

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
442662

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 49992

> <CITATION>
-

$$$$