LMPK12110092
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.0607    8.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    7.6412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9273    7.1407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7940    7.6412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7940    8.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9273    9.1421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6607    7.1407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5275    7.6412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5275    8.6418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6607    9.1421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6607    6.3605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3937    9.1420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2771    8.6321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1604    9.1420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1604   10.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2771   10.6719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3937   10.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0434    8.6323    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5106   10.6717    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9246    9.1409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8058    8.6323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9246   10.1584    0.0000 O   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
  9 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 17  2  0  0  0  0
 17 12  1  0  0  0  0
 14 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
M  END
> <LM_ID>
LMPK12110092

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
2',5'-Dihydroxyflavone 5'-acetate

> <FORMULA>
C17H12O5

> <MASS>
296.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MUJHEVWVPDGOKN-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H12O5/c1-10(18)21-11-6-7-14(19)13(8-11)17-9-15(20)12-4-2-3-5-16(12)22-17/h2-9,19H,1H3

> <SMILES>
C1=CC2OC(C3C(O)=CC=C(OC(=O)C)C=3)=CC(=O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
193236

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257596

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 184994

> <CITATION>
-

$$$$