LMPK12160016
  LIPID_MAPS_STRUCTURE_DATABASE

 27 31  0     0  0            999 V2000
    7.5261   10.0668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5276    9.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3536    8.6387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1781    9.1165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1764   10.0694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3504   10.5445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0040    8.6413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8282    9.1193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8268   10.0722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0008   10.5474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6544    8.6442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6559    7.6256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5390    7.1174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4204    7.6282    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4190    8.6470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5360    9.1550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6514   10.5501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3898    7.3148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9874    8.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3873    8.9633    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6190   10.3595    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.5877    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6219    8.8179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3488   11.5445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2140   12.0459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7906    7.1243    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.9238    7.6230    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
  1  2  1  0  0  0  0
  9 17  2  0  0  0  0
 14 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 15  1  0  0  0  0
  1 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23  2  1  0  0  0  0
  6 24  1  0     0  0
 24 25  1  0     0  0
 12 26  1  0     0  0
 26 27  1  0     0  0
M  END
> <LM_ID>
LMPK12160016

> <COMMON_NAME>
Neofolin

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H14O7

> <MASS>
366.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Other Flavonoids [PK1216]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SUNDAONUHLDQBY-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H14O7/c1-22-14-8-16-15(25-9-26-16)7-12(14)13-6-11-5-10-3-4-24-17(10)19(23-2)18(11)27-20(13)21/h3-8H,9H2,1-2H3

> <SMILES>
C12OC=CC1=CC1C=C(C3=CC4OCOC=4C=C3OC)C(=O)OC=1C=2OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
185792

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44260104

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 167619

> <CITATION>
-

$$$$