LMPK12110183
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    9.6436    8.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6436    9.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7775    9.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9115    9.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9115    8.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7775    7.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5095    7.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3756    8.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3756    9.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5095    9.8607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2417    9.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1076    9.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9737    9.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9737   10.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1076   11.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2417   10.8607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5095    6.8607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7775    6.8607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9115    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7775   10.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9115   11.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0454   10.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0454    9.8607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.6870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7034   11.8003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9115   12.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0454   13.8606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0454   12.8606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1794   12.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6436   11.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7775   12.8606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6436   12.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5095   12.8606    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
  1  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  2  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  6 18  1  0  0  0  0
 18 19  1  0  0  0  0
  3 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23  4  1  0  0  0  0
 22 24  1  0  0  0  0
 22 25  1  0  0  0  0
 21 26  1  6  0  0  0
 26 28  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 20 30  1  1  0  0  0
 30 32  1  0  0  0  0
 31 32  2  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110183

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
(9R,10S)-rel-(-)-9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one

> <FORMULA>
C25H24O8

> <MASS>
452.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WFAOFDKMYNXISN-BJKOFHAPSA-N

> <INCHI>
InChI=1S/C25H24O8/c1-13(26)30-23-21-19(33-25(3,4)24(23)31-14(2)27)12-18(29-5)20-16(28)11-17(32-22(20)21)15-9-7-6-8-10-15/h6-12,23-24H,1-5H3/t23-,24+/m0/s1

> <SMILES>
C12C(=O)C=C(C3C=CC=CC=3)OC=1C1[C@H](OC(C)=O)[C@@H](OC(C)=O)C(C)(C)OC=1C=C2OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
188112

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11080904

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 56065

> <CITATION>
14510596

$$$$