LMPK12120057
  LIPID_MAPS_STRUCTURE_DATABASE

 30 31  0  0  0  0  0  0  0  0999 V2000
    7.1634    7.0614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9477    7.5142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9477    8.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1634    8.8727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3791    8.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3791    7.5142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1634    9.5840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7609    7.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1634    6.2593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3599    5.7954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6976    6.1777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.1777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7083    8.8589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7083    9.5826    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4225    8.4466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1563    8.8703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8270    8.4830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8270    7.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5951    7.1525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3633    7.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3633    8.4830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5951    8.9265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0192    7.2173    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5951    6.4119    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8162    5.9623    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.8162    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0823    6.3860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0823    7.0236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5869    5.8908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2696    5.4365    0.0000 C   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
  4  7  1  0  0  0  0
  6  8  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
  3 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
 20 23  1  0  0  0  0
 19 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
 11 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12120057

> <COMMON_NAME>
Bartericin D

> <SYSTEMATIC_NAME>


> <FORMULA>
C25H28O5

> <MASS>
408.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Chalcones and dihydrochalcones [PK1212]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZDJNKVKJBADENN-JXMROGBWSA-N

> <INCHI>
InChI=1S/C25H28O5/c1-15(2)5-8-18-12-20(25(30)14-24(18)29)22(27)10-7-17-6-9-21(26)19(11-17)13-23(28)16(3)4/h5-7,9-12,14,23,26,28-30H,3,8,13H2,1-2,4H3/b10-7+

> <SMILES>
C1(CC=C(C)C)C(O)=CC(O)=C(C(/C=C/C2C=CC(O)=C(CC(C(C)=C)O)C=2)=O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21580532

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$