LMPK12050363
  LIPID_MAPS_STRUCTURE_DATABASE

 24 26  0     0  0            999 V2000
    7.5670    9.3510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5670    8.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4016    7.9058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2360    8.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2360    9.3510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4016    9.8328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0704    7.9059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9050    8.3876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9050    9.3510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0704    9.8328    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7394    7.9059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7394    6.8758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6316    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5237    6.8758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5237    7.9059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6316    8.4211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0704    6.9423    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4016    6.9423    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.8328    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9050    6.3939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3582    8.3876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4299    7.7688    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    7.9059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.6682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 21 22  1  0  0  0  0
 23 24  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
 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
  3 18  1  0  0  0  0
  1 19  1  0  0  0  0
 12 20  1  0  0  0  0
  2 23  1  0  0  0  0
 15 21  1  0  0  0  0
M  END
> <LM_ID>
LMPK12050363

> <COMMON_NAME>
Podospicatin

> <SYSTEMATIC_NAME>
5,7,2'-Trihydroxy-6,5'-dimethoxyisoflavone

> <FORMULA>
C17H14O7

> <MASS>
330.07

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OJZJQMVCYJGFGG-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O7/c1-22-8-3-4-11(18)9(5-8)10-7-24-13-6-12(19)17(23-2)16(21)14(13)15(10)20/h3-7,18-19,21H,1-2H3

> <SMILES>
C1(O)=CC2OC=C(C3C=C(OC)C=CC=3O)C(=O)C=2C(O)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12314411

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 56903

> <CITATION>
-

$$$$