LMPK12110487
  LIPID_MAPS_STRUCTURE_DATABASE

 41 45  0  0  0  0  0  0  0  0999 V2000
   10.5796    8.7446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5796    7.7380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4512    7.2347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3230    7.7380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3230    8.7446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4512    9.2478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1946    7.2347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0662    7.7380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0662    8.7446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1946    9.2478    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1946    6.4499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7081    9.2477    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4512    6.2285    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0347    9.2799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9531    8.7495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8717    9.2799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8717   10.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9531   10.8709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0347   10.3406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.7899   10.8706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7899    8.7499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7047   10.2289    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7048   12.1890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3996   13.1647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2509   10.7193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4007   10.2268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5521   10.7167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5535   11.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4008   12.1870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2494   11.6970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5878    5.7772    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8903    4.7972    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1980    5.7770    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8901    7.7370    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4509    7.1031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7416    7.2470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7416    6.2672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8901    5.7770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0441    6.2670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0441    7.2469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1980    7.7369    0.0000 C   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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  1 12  1  0  0  0  0
  3 13  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 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 14  9  1  0  0  0  0
 17 20  1  0  0  0  0
 16 21  1  0  0  0  0
 30 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 27 22  1  6     0  0
 28 23  1  1     0  0
 29 24  1  6     0  0
 35 41  1  0     0  0
 40 34  1  0     0  0
 34 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  0     0  0
 39 40  1  0     0  0
 40 41  1  1     0  0
 37 31  1  6     0  0
 38 32  1  1     0  0
 39 33  1  6     0  0
 26  6  1  1     0  0
 36  2  1  1     0  0
M  END
> <LM_ID>
LMPK12110487

> <COMMON_NAME>
Lucenin 3

> <SYSTEMATIC_NAME>


> <FORMULA>
C26H28O15

> <MASS>
580.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XBGYTZHKGMCEGE-MCIQUCDDSA-N

> <INCHI>
InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)15-19(34)14-10(30)4-12(7-1-2-8(28)9(29)3-7)40-24(14)16(20(15)35)25-22(37)17(32)11(31)6-39-25/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2/t11-,13-,17+,18-,21+,22-,23-,25+,26+/m1/s1

> <SMILES>
C1(O)=C([C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)C2OC(C3C=CC(O)=C(O)C=3)=CC(=O)C=2C(O)=C1[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101423626

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 384982

> <CITATION>
-

$$$$