LMPK12140642
  LIPID_MAPS_STRUCTURE_DATABASE

 27 29  0  0  0  0  0  0  0  0999 V2000
    7.8452    7.0532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8560    6.2401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5808    5.8311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2829    6.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2828    7.0687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5628    7.4810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0117    5.8314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7119    6.2439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7047    7.0811    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.9972    7.4813    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4190    7.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1279    7.0935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8409    7.5061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8403    8.3318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1261    8.7434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4118    8.3309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0117    5.0064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1308    7.4657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5808    5.0062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1279    6.2685    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5628    8.3060    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8466    8.7195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1416    5.8277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4295    6.2388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7139    5.8257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7139    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2377    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  1  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  2  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 12 20  1  0  0  0  0
  6 21  1  0  0  0  0
 21 22  1  0  0  0  0
  2 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140642

> <COMMON_NAME>
Dioflorin

> <SYSTEMATIC_NAME>
(2R)-5,7,2'-Trihydroxy-8-methoxy-6-prenylflavanone

> <FORMULA>
C21H22O6

> <MASS>
370.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DWICVFARTYFNMY-MRXNPFEDSA-N

> <INCHI>
InChI=1S/C21H22O6/c1-11(2)8-9-13-18(24)17-15(23)10-16(12-6-4-5-7-14(12)22)27-20(17)21(26-3)19(13)25/h4-8,16,22,24-25H,9-10H2,1-3H3/t16-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
177421

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$