LMPK12110476
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    7.9110   11.1481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9790   11.6862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9790   12.5102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2946   11.2911    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7848    9.5686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7848    8.5352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6798    8.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5749    8.5352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5749    9.5686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6798   10.0854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4698    8.0186    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3648    8.5352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3648    9.5686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4698   10.0854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4698    7.2129    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8903   10.0851    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3590   10.1183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2918    9.5564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2448   10.0837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2647   11.1724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3317   11.7341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3790   11.2072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1597   11.6891    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6798    6.9855    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3317   12.7676    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9382   13.1182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6689   14.1145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5382   11.6172    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2231   14.0981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6701   11.1143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8035   11.6146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8048   12.6180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6702   13.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5367   12.6157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4021   13.1138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  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  2  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14  9  1  0  0  0  0
 11 15  2  0  0  0  0
  5 16  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 17  1  0  0  0  0
 17 13  1  0  0  0  0
 20 23  1  0  0  0  0
  7 24  1  0  0  0  0
 21 25  1  0  0  0  0
 29 35  1  0     0  0
 34 28  1  0     0  0
 28 30  1  0     0  0
 30 31  1  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  1     0  0
 32 26  1  1     0  0
 33 27  1  6     0  0
 30 10  1  1     0  0
 31  1  1  6     0  0
M  END
> <LM_ID>
LMPK12110476

> <COMMON_NAME>
Orientin 2''-acetate

> <SYSTEMATIC_NAME>


> <FORMULA>
C23H22O12

> <MASS>
490.11

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BUWALTSLLYTARL-MMAASCIUSA-N

> <INCHI>
InChI=1S/C23H22O12/c1-8(25)33-23-20(32)19(31)16(7-24)35-22(23)18-13(29)5-12(28)17-14(30)6-15(34-21(17)18)9-2-3-10(26)11(27)4-9/h2-6,16,19-20,22-24,26-29,31-32H,7H2,1H3/t16-,19-,20+,22+,23-/m1/s1

> <SMILES>
O([C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1C1=C(O)C=C(O)C2C(=O)C=C(C3C=C(O)C(O)=CC=3)OC=21)C(=O)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14681461

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$