LMPK12060025
  LIPID_MAPS_STRUCTURE_DATABASE

 27 31  0     0  0            999 V2000
    6.7734   10.6137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7734    9.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6043    9.1746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4353    9.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4353   10.6137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6043   11.0934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2662    9.1746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0971    9.6542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0971   10.6137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2662   11.0934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9276    9.1748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9276    8.1491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8160    7.6362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7045    8.1491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7045    9.1748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8160    9.6876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2662    8.2153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8565   10.6137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9280   11.0934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4050   12.0319    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4508   12.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   11.2556    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6043    8.2153    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8160    6.6767    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8831    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5352    7.6693    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8287    8.4161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 24 25  1  0  0  0  0
 26 27  1  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  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  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19  9  1  0  0  0  0
  6 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22  1  1  0  0  0  0
  3 23  1  0  0  0  0
 13 24  1  0  0  0  0
 14 26  1  0  0  0  0
M  END
> <LM_ID>
LMPK12060025

> <COMMON_NAME>
Malaccol

> <SYSTEMATIC_NAME>
[6aS,(+)]-12,12aalpha-Dihydro-5-hydroxy-8,9-dimethoxy-[1]benzopyrano[3,4-b]furo[3,2-h][1]benzopyran-6(6aalphaH)-one

> <FORMULA>
C20H16O7

> <MASS>
368.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Rotenoid flavonoids [PK1206]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(R)-1,2-Dihydro-5-hydroxy-8,9-dimethoxy-2-(1-methylvinyl)[1]benzopyrano[3,4-b]furo[2,3-h][1]benzopyran-6(12H)-one

> <INCHI_KEY>
WEMVDFMZCALBHH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H16O7/c1-23-14-5-10-13(7-15(14)24-2)26-8-16-17(10)19(22)18-11(21)6-12-9(3-4-25-12)20(18)27-16/h3-7,16-17,21H,8H2,1-2H3

> <SMILES>
C12OC=CC=1C1OC3COC4=C(C=C(OC)C(OC)=C4)C3C(=O)C=1C(O)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5319228

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 53864

> <CITATION>
-

$$$$