LMPK12110428
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0  0  0  0  0  0  0  0999 V2000
    9.3314    7.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3314    8.8614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4652    9.3615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4651    7.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1977    7.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0640    7.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0640    8.8614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1977    9.3615    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9303    9.3615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7967    8.8614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6630    9.3615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6630   10.3619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7967   10.8620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9303   10.3619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1977    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5989    7.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5989    8.8614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5291    8.8614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3954    9.3615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3954   10.3619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5291   10.8620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7967   11.8622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9303   12.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0655   11.8631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9303   13.3610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0655   10.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2021   12.3616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2618   10.8620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3954   11.3621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4651    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.3615    0.0000 O   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 17  2  0  0  0  0
 16  4  2  0  0  0  0
  4  1  1  0  0  0  0
  1  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  2  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 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  9  1  0  0  0  0
  5 15  2  0  0  0  0
 17 16  1  0  0  0  0
 11 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 12  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 24 26  2  0  0  0  0
 24 27  1  0  0  0  0
 20 28  1  0  0  0  0
 20 29  1  0  0  0  0
  4 30  1  0  0  0  0
 17 31  1  0  0  0  0
M  END
> <LM_ID>
LMPK12110428

> <COMMON_NAME>
Yinyanghuo A

> <SYSTEMATIC_NAME>
(-)-5,7-Dihydroxy-2-[8-(2-hydroxy-3-methyl-3-butenyl)-2,2-dimethyl-2H-1-benzopyran-6-yl]-4H-1-benzopyran-4-one

> <FORMULA>
C25H24O6

> <MASS>
420.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZAUWPDSVLSOCDG-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H24O6/c1-13(2)18(27)9-16-8-15(7-14-5-6-25(3,4)31-24(14)16)21-12-20(29)23-19(28)10-17(26)11-22(23)30-21/h5-8,10-12,18,26-28H,1,9H2,2-4H3

> <SMILES>
C12C(=O)C=C(C3C=C(CC(O)C(C)=C)C4OC(C)(C)C=CC=4C=3)OC=1C=C(O)C=C2O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
66492

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5315393

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 253616

> <CITATION>
-

$$$$