LMPK12050100
  LIPID_MAPS_STRUCTURE_DATABASE

 22 24  0     0  0            999 V2000
    8.3284   10.8278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3284    9.8687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1590    9.3893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9896    9.8687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9896   10.8278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1590   11.3073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8202    9.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6508    9.8687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6508   10.8278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8202   11.3073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4979   11.3073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8202    8.4302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4812    9.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4812    8.4998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2515    8.0552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0217    8.4998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0217    9.3892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2515    9.8338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8521    8.0202    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4979    9.3892    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6319    9.8892    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8521    7.0202    0.0000 C   0  0  0  0  0  0  0  0  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
  1 11  1  0  0  0  0
  7 12  2  0  0  0  0
  8 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 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
  2 20  1  0  0  0  0
 20 21  1  0     0  0
 19 22  1  0     0  0
M  END
> <LM_ID>
LMPK12050100

> <COMMON_NAME>
Afrormosin

> <SYSTEMATIC_NAME>
7-Hydroxy-6-methoxy-3-(4-methoxyphenyl)-4H-1-benzopyran-4-one

> <FORMULA>
C17H14O5

> <MASS>
298.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Isoflavonoids [PK1205]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Afromosin

> <INCHI_KEY>
KJGPBYUQZLUKLL-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)13-9-22-15-8-14(18)16(21-2)7-12(15)17(13)19/h3-9,18H,1-2H3

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

> <KEGG_ID>
C10199

> <HMDB_ID>
HMDB0132849

> <CHEBI_ID>
2506

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5281704

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 167663

> <CITATION>
-

$$$$