LMPK12111473
  LIPID_MAPS_STRUCTURE_DATABASE

 26 28  0  0  0  0  0  0  0  0999 V2000
    7.5620    9.0271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5620    8.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3913    7.5907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2205    8.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2205    9.0271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3913    9.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0500    7.5907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8792    8.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8791    9.0272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0497    9.5059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0500    6.6331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7084    9.5059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5536    9.0180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3987    9.5060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3987   10.4820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5533   10.9697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7084   10.4819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.5057    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3913    6.6331    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5533   11.9274    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2279   10.9607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2932   10.3457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7328    7.5907    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7328    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3913   10.4633    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6822   11.2088    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
 25 26  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
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
  3 19  1  0  0  0  0
 16 20  1  0  0  0  0
 15 21  1  0  0  0  0
  2 23  1  0  0  0  0
  6 25  1  0  0  0  0
M  END
> <LM_ID>
LMPK12111473

> <COMMON_NAME>
Acerosin

> <SYSTEMATIC_NAME>
3',5,7-Trihydroxy-4',6,8-trimethoxyflavone

> <FORMULA>
C18H16O8

> <MASS>
360.08

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BTMNGQCCCWTUQH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H16O8/c1-23-11-5-4-8(6-9(11)19)12-7-10(20)13-14(21)17(24-2)15(22)18(25-3)16(13)26-12/h4-7,19,21-22H,1-3H3

> <SMILES>
C1(O)=C(OC)C2OC(C3C=C(O)C(OC)=CC=3)=CC(=O)C=2C(O)=C1OC

> <KEGG_ID>
C09982

> <HMDB_ID>
HMDB0030812

> <CHEBI_ID>
2382

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
177696

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 2042397

> <CITATION>
-

$$$$