LMPK12020293
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0     0  0            999 V2000
    5.2250    6.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0910    6.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0910    5.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2250    4.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3590    5.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3590    6.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9571    6.8750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231    6.3751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231    5.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9571    4.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4930    6.8750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6269    6.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2250    7.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3590    8.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3590    9.3750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4929    9.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2250    9.8750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6891    6.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6891    7.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5552    8.3751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4212    7.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4212    6.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5552    6.3751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2872    8.3751    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1533    7.8751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  6 11  1  0     0  0
 11 12  1  0     0  0
  1 13  1  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 15 17  1  0     0  0
  8 18  1  0     0  0
 18 19  1  0     0  0
 19 20  2  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 22 23  1  0     0  0
 23 18  2  0     0  0
 21 24  1  0     0  0
 24 25  1  0     0  0
M  END
> <LM_ID>
LMPK12020293

> <COMMON_NAME>
Acutifolin B

> <SYSTEMATIC_NAME>
7-methoxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromene

> <FORMULA>
C22H26O3

> <MASS>
338.19

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YVUIGWVIBZIHEC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C22H26O3/c1-15(2)5-12-19-21(24-4)14-9-17-8-13-20(25-22(17)19)16-6-10-18(23-3)11-7-16/h5-7,9-11,14,20H,8,12-13H2,1-4H3

> <SMILES>
C1(C/C=C(\C)/C)=C(OC)C=CC2CCC(C3=CC=C(OC)C=C3)OC1=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11727485

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1835378

> <CITATION>
11754597

$$$$