LMPK12140439
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0  0  0  0  0  0  0  0999 V2000
    7.3561   -7.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3561   -8.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1969   -9.0643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0379   -8.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0379   -7.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1969   -7.1225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8786   -9.0643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7196   -8.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7196   -7.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8787   -7.1223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5606   -7.1223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4248   -7.6214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2889   -7.1223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2889   -6.1244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4248   -5.6256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5606   -6.1244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7196   -6.6369    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1969  -10.0353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5154   -7.1223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8786  -10.0353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1299   -5.6391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1299   -7.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9708   -7.1223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8116   -7.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6525   -7.1223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8116   -8.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4248   -4.6546    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2908   -4.1546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  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  0  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
  9 17  1  1  0  0  0
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
  7 20  2  0  0  0  0
 14 21  1  0  0  0  0
 13 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 15 27  1  0  0  0  0
 27 28  1  0     0  0
M  END
> <LM_ID>
LMPK12140439

> <COMMON_NAME>
5'-Prenylhomoeriodictyol

> <SYSTEMATIC_NAME>
2-[3-Methoxy-4-hydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxychroman-4-one

> <FORMULA>
C21H22O6

> <MASS>
370.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Abyssinoflavanone II; Abyssinin II

> <INCHI_KEY>
UQFQODVSORPELA-KRWDZBQOSA-N

> <INCHI>
InChI=1S/C21H22O6/c1-11(2)4-5-12-6-13(7-19(26-3)21(12)25)17-10-16(24)20-15(23)8-14(22)9-18(20)27-17/h4,6-9,17,22-23,25H,5,10H2,1-3H3/t17-/m0/s1

> <SMILES>
C1(O)C=C2O[C@]([H])(C3C=C(OC)C(O)=C(C/C=C(\C)/C)C=3)CC(=O)C2=C(O)C=1

> <KEGG_ID>
C09831

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
442457

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1237573

> <CITATION>
-

$$$$