LMPK12050359
  LIPID_MAPS_STRUCTURE_DATABASE

 33 35  0  0  0  0  0  0  0  0999 V2000
    5.8827   10.6576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8827    9.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5724    9.4629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2621    9.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2621   10.6576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5724   11.0558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9518    9.4630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6415    9.8611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6415   10.6576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9518   11.0558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3312    9.4629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3312    8.6115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0687    8.1858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8061    8.6115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8061    9.4629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0687    9.8886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9518    8.6666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4959    8.2133    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0687    7.3893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7585    6.9911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7585    6.1947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4482    5.7964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4482    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1379    6.1947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1856    8.6115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8753    8.2133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5652    8.6115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2549    8.2133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5652    9.4080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5724    8.6665    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4583    8.1550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930   11.0558    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930   12.2956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 30 31  1  0  0  0  0
 32 33  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  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  2  0  0  0  0
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 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
 14 18  1  0  0  0  0
 13 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 18 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
  1 32  1  0  0  0  0
  3 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050359

> <COMMON_NAME>
Glabrescione B

> <SYSTEMATIC_NAME>
5,7-Dimethoxy-3',4'-diprenyloxyisoflavone

> <FORMULA>
C27H30O6

> <MASS>
450.20

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RHXDATRKLOYVTC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C27H30O6/c1-17(2)9-11-31-22-8-7-19(13-23(22)32-12-10-18(3)4)21-16-33-25-15-20(29-5)14-24(30-6)26(25)27(21)28/h7-10,13-16H,11-12H2,1-6H3

> <SMILES>
C1(OC)=CC2OC=C(C3C=CC(OC/C=C(\C)/C)=C(OC/C=C(\C)/C)C=3)C(=O)C=2C(OC)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
186122

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44257338

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$