LMPK12020190
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.2494    7.0460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2494    6.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9444    5.8422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6394    6.2435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6394    7.0460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9444    7.4473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3344    5.8422    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0294    6.2435    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0294    7.0460    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3344    7.4473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7244    7.4473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4327    7.0384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410    7.4473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1410    8.2653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4327    8.6743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7244    8.2653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3344    5.0396    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.4473    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8362    8.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7244    5.8422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9444    8.2498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0263    8.8744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  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
  9 11  1  6  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  1  6  0  0  0
 18  1  1  0  0  0  0
 14 19  1  0  0  0  0
  8 20  1  6  0  0  0
  6 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020190

> <COMMON_NAME>
Epioritin-4alpha-ol 8-methyl ether

> <SYSTEMATIC_NAME>


> <FORMULA>
C16H16O6

> <MASS>
304.09

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavans, Flavanols and Leucoanthocyanidins [PK1202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GTCSLCFHBRXPGV-MGPQQGTHSA-N

> <INCHI>
InChI=1S/C16H16O6/c1-21-16-11(18)7-6-10-12(19)13(20)14(22-15(10)16)8-2-4-9(17)5-3-8/h2-7,12-14,17-20H,1H3/t12-,13-,14-/m1/s1

> <SMILES>
C1(O)=C(OC)C2O[C@H](C3C=CC(O)=CC=3)[C@H](O)[C@H](O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257147

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$