LMPK12140618
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0  0  0  0  0  0  0  0999 V2000
    5.7571    7.0548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7571    6.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4690    5.8218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1809    6.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1809    7.0548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4690    7.4659    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8928    5.8218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6047    6.2329    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6047    7.0548    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8928    7.4659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3164    7.4658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0418    7.0468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7674    7.4658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7674    8.3036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0418    8.7224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3164    8.3036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8928    5.1259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4920    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5212    8.7388    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4690    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0454    5.8220    0.0000 O   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  1  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
 18  1  1  0  0  0  0
 14 19  1  0  0  0  0
  3 20  1  0  0  0  0
  2 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140618

> <COMMON_NAME>
Carthamidin

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H12O6

> <MASS>
288.06

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NPLTVGMLNDMOQE-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H12O6/c16-8-3-1-7(2-4-8)11-5-9(17)13-12(21-11)6-10(18)14(19)15(13)20/h1-4,6,11,16,18-20H,5H2

> <SMILES>
C1(O)=CC2OC(C3C=CC(O)=CC=3)CC(=O)C=2C(O)=C1O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0141183

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9879022

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$