LMPK12140491
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0  0  0  0  0  0  0  0999 V2000
    9.7497   -7.5155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7640   -8.5243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6836   -8.9952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5351   -8.4869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5350   -7.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6482   -6.9628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4497   -8.9948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2952   -8.4867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2778   -7.4406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4150   -6.9625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1579   -6.9326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0260   -7.4115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9008   -6.9026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9004   -5.8851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0192   -5.3785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1403   -5.8867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4497  -10.0109    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8696   -7.0074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6836  -10.0112    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.7804   -5.3770    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0192   -4.3623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1392   -3.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0260   -8.4277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8513   -9.0513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0624   -8.5959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3166   -9.0264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3166   -9.9474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6091   -8.6180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  6  1  1  0     0  0
  4  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  5  1  0     0  0
  9 11  1  6     0  0
 11 12  2  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 11  1  0     0  0
  7 17  2  0     0  0
  1 18  1  0     0  0
  3 19  1  0     0  0
 14 20  1  0     0  0
 21 22  1  0     0  0
 15 21  1  0     0  0
 12 23  1  0     0  0
  2 24  1  0     0  0
 24 25  1  0     0  0
 25 26  2  0     0  0
 26 27  1  0     0  0
 26 28  1  0     0  0
M  END
> <LM_ID>
LMPK12140491

> <COMMON_NAME>
Kushenol V

> <SYSTEMATIC_NAME>
(2S)-5,7,2',4'-Tetrahydroxy-5'-methoxy-6-prenylflavanone

> <FORMULA>
C21H22O7

> <MASS>
386.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NNBXZDZKDHWELJ-KRWDZBQOSA-N

> <INCHI>
InChI=1S/C21H22O7/c1-10(2)4-5-11-14(23)8-19-20(21(11)26)16(25)9-17(28-19)12-6-18(27-3)15(24)7-13(12)22/h4,6-8,17,22-24,26H,5,9H2,1-3H3/t17-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
197179

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10572194

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 49840

> <CITATION>
10654410

$$$$