LMPK12100029
  LIPID_MAPS_STRUCTURE_DATABASE

 30 33  0  0  0  0  0  0  0  0999 V2000
    9.3189   10.7188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2000   11.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0808   10.7190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0808    9.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9942    9.1370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9076    9.6644    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9076   10.7190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9942   11.2463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3189    9.7021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2000    9.1936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9942    8.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1185    7.5774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1185    6.5663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9942    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8699    6.5663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8699    7.5774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8203   11.2461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2000   12.2448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3189   12.7535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2000    8.3244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4383   11.2270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5581    9.7021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4383    9.1940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8092    9.2697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4383    8.1570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4383   12.2448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6862   11.8105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4383   13.2254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.7021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5581   10.5283    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  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  5 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
  2 18  1  0  0  0  0
 18 19  2  0  0  0  0
 10 20  1  0  0  0  0
  1 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23  9  1  0  0  0  0
 22 24  1  0  0  0  0
 23 25  2  0  0  0  0
 19 26  1  0  0  0  0
 26 21  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 24 29  1  0  0  0  0
 22 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12100029

> <COMMON_NAME>
MAB5

> <SYSTEMATIC_NAME>
5-Hydroxy-6'',6''-dimethyl-6-(2-methylbutyryl)-4-phenylpyrano[2'',3'':7,8]coumarin

> <FORMULA>
C25H24O5

> <MASS>
404.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Neoflavonoids [PK1210]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YJSXHUXXMDAOCE-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O5/c1-5-14(2)21(27)20-22(28)19-17(15-9-7-6-8-10-15)13-18(26)29-23(19)16-11-12-25(3,4)30-24(16)20/h6-14,28H,5H2,1-4H3

> <SMILES>
C12OC(C)(C)C=CC=1C1OC(=O)C=C(C3C=CC=CC=3)C=1C(O)=C2C(=O)C(C)CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
15223665

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 999584

> <CITATION>
-

$$$$