LMPK12111445
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0  0  0  0  0  0  0  0999 V2000
    7.5595    8.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5595    7.5453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864    7.0679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2133    7.5453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2133    8.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864    8.9777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0403    7.0679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8672    7.5453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8672    8.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0403    8.9777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0403    6.1131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6941    8.9777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5369    8.4911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3800    8.9777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3800    9.9509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5369   10.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6941    9.9509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    7.0679    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864    6.1131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2069   10.4283    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    8.9777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326   10.4641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3864    9.9326    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6737   10.6758    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
  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
  1 21  1  0  0  0  0
  6 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111445

> <COMMON_NAME>
Thymusin

> <SYSTEMATIC_NAME>
5,6-Dihydroxy-2-(4-hydroxyphenyl)-7,8-dimethoxy-4H-1-benzopyran-4-one

> <FORMULA>
C17H14O7

> <MASS>
330.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
5,6,4'-Trihydroxy-7,8-dimethoxyflavone

> <INCHI_KEY>
DAUMHRNXYGHXIC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O7/c1-22-16-14(21)13(20)12-10(19)7-11(24-15(12)17(16)23-2)8-3-5-9(18)6-4-8/h3-7,18,20-21H,1-2H3

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
628895

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1107925

> <CITATION>
-

$$$$