LMPK12020185
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.1632    7.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1632    6.4760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8726    6.0664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5821    6.4760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5821    7.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8726    7.7047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2915    6.0664    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0009    6.4760    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.0009    7.2951    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.2915    7.7047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7101    7.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4331    7.2872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1561    7.7046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1561    8.5395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4331    8.9569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7101    8.5395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2915    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    7.8433    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8790    8.9567    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7101    6.0665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4331    9.7915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8790    7.2872    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  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  1  0  0  0
 15 21  1  0  0  0  0
 13 22  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020185

> <COMMON_NAME>
Robinetinidol-4alpha-ol

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H14O7

> <MASS>
306.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OIDNVHGBTSUBEW-VHDGCEQUSA-N

> <INCHI>
InChI=1S/C15H14O7/c16-7-1-2-8-11(5-7)22-15(14(21)12(8)19)6-3-9(17)13(20)10(18)4-6/h1-5,12,14-21H/t12-,14+,15-/m1/s1

> <SMILES>
C1(O)=CC2O[C@H](C3C=C(O)C(O)=C(O)C=3)[C@@H](O)[C@H](O)C=2C=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186119

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257144

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$