LMPK12020163
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0     0  0            999 V2000
    7.8835    9.1304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8835    8.1535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7297    7.6649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5757    8.1535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5757    9.1304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7297    9.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4218    7.6649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2678    8.1535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2678    9.1304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4218    9.6189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1139    9.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9763    9.1209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8386    9.6188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8386   10.6145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9763   11.1122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1139   10.6145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7297   10.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8835   11.0843    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0374   10.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0374    9.6189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5491   11.4420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606   10.5960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7297    6.6880    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8163    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4218    6.6880    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5084    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 23 24  1  0  0  0  0
 25 26  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
  6 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20  1  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
  7 25  1  1  0  0  0
  3 23  1  0  0  0  0
M  END
> <LM_ID>
LMPK12020163

> <COMMON_NAME>
Methylhildgardtol B

> <SYSTEMATIC_NAME>
4,5-Dimethoxy-8,8-dimethyl-8H-pyrano[2,3-h]flavan

> <FORMULA>
C22H24O4

> <MASS>
352.17

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DCNIJWYZTHCFLC-FUHWJXTLSA-N

> <INCHI>
InChI=1S/C22H24O4/c1-22(2)11-10-15-17(26-22)13-19(24-4)20-18(23-3)12-16(25-21(15)20)14-8-6-5-7-9-14/h5-11,13,16,18H,12H2,1-4H3/t16-,18+/m0/s1

> <SMILES>
C12OC(C)(C)C=CC=1C1O[C@H](C3C=CC=CC=3)C[C@@H](OC)C=1C(OC)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21676331

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 47097

> <CITATION>
-

$$$$