LMPK12090021
  LIPID_MAPS_STRUCTURE_DATABASE

 24 29  0  0  0  0  0  0  0  0999 V2000
    7.5246    9.0132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5246    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3486    7.5863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1725    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1725    9.0132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3486    9.4890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9963    7.5863    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8202    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8202    9.0132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9963    9.4890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6439    7.5864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6439    6.5692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5248    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4056    6.5692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4056    7.5864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5248    8.0950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0050    6.5694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6439    9.4888    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3731    6.2549    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9709    7.0778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3731    7.9007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6197    9.3073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.5376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6197    7.7680    0.0000 C   0  0  0  0  0  0  0  0  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  2  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
  8 11  1  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 11  2  0  0  0  0
  7 17  1  0  0  0  0
  1  2  1  0  0  0  0
 12 17  1  0  0  0  0
  9 18  2  0  0  0  0
 14 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 15  1  0  0  0  0
  1 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24  2  1  0  0  0  0
M  END
> <LM_ID>
LMPK12090021

> <COMMON_NAME>
Erosnin

> <SYSTEMATIC_NAME>
6H-[1,3]Dioxolo[5,6]benzofuro[3,2-c]furo[3,2-g][1]benzopyran-6-one

> <FORMULA>
C18H8O6

> <MASS>
320.03

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Coumestan flavonoids [PK1209]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Erosnine

> <INCHI_KEY>
YQXNKHVPEJJBTJ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H8O6/c19-18-16-9-4-14-15(22-7-21-14)6-12(9)23-17(16)10-3-8-1-2-20-11(8)5-13(10)24-18/h1-6H,7H2

> <SMILES>
C12OC=CC1=CC1C3OC4=CC5OCOC=5C=C4C=3C(=O)OC=1C=2

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0029465

> <CHEBI_ID>
169158

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5317189

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 109170

> <CITATION>
-

$$$$