LMPK12130020
  LIPID_MAPS_STRUCTURE_DATABASE

 21 23  0  0  0  0  0  0  0  0999 V2000
    8.6416    7.2602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6416    8.2537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7814    8.7505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9208    8.2537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9208    7.2602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7814    6.7635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5865    6.9532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1705    7.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5865    8.5608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.7503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9024    7.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3670    7.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8647    6.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8598    6.8952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3573    7.7570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8598    8.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8647    8.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3507    7.7570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8256    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3564    9.4791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7814    9.7439    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  2  1  0  0  0  0
  4 10  1  0  0  0  0
  8 11  2  0  0  0  0
 11 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
 15 18  1  0  0  0  0
  7 19  2  0  0  0  0
 16 20  1  0  0  0  0
  3 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12130020

> <COMMON_NAME>
Maritimetin

> <SYSTEMATIC_NAME>
6,7-Dihydroxy-2-[(Z)-3,4-dihydroxyphenylmethylene]benzofuran-3(2H)-one

> <FORMULA>
C15H10O6

> <MASS>
286.05

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Aurone flavonoids [PK1213]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
3',4',6,7-tetrahydroxyaurone

> <INCHI_KEY>
PNIFOHGQPKXLJE-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C15H10O6/c16-9-3-1-7(5-11(9)18)6-12-13(19)8-2-4-10(17)14(20)15(8)21-12/h1-6,16-18,20H

> <SMILES>
C12C(=O)C(=CC3C=C(O)C(O)=CC=3)OC=1C(O)=C(O)C=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
441768

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 51268

> <CITATION>
-

$$$$