LMPK12112928
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0  0  0  0  0  0  0  0999 V2000
    9.4383   11.1334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4383   10.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3083    9.6265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1783   10.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1783   11.1334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3083   11.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0483    9.6265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9181   10.1290    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9181   11.1334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0483   11.6357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0483    8.6220    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7882   11.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6750   11.1236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5617   11.6357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5617   12.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6750   13.1714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7882   12.6595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5683   11.6357    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3083    8.6221    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4317   13.1620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5683    9.6268    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.7882    9.6268    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6750   14.1760    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4787   14.6401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5522   10.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9469   10.2481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8160    6.6722    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3809    5.2574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4433    5.7939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6192    8.1824    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3565    6.9198    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5934    7.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8472    6.9405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1269    6.2322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1582    6.5006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9044    7.4755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9356    7.7438    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
  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
 20 15  1  0  0  0  0
  2 21  1  0  0  0  0
  8 22  1  0  0  0  0
 16 23  1  0  0  0  0
 23 24  1  0  0  0  0
 22 25  1  0  0  0  0
 21 26  1  0  0  0  0
 31 37  1  0     0  0
 36 30  1  0     0  0
 30 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  1     0  0
 32 19  1  1     0  0
 33 27  1  6     0  0
 34 28  1  1     0  0
 35 29  1  6     0  0
M  END
> <LM_ID>
LMPK12112928

> <COMMON_NAME>
Jaceidin 5-glucoside

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

> <FORMULA>
C24H26O13

> <MASS>
522.14

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavones and Flavonols [PK1211]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WFTGLRVDKFXNSB-HPCJZBTHSA-N

> <INCHI>
InChI=1S/C24H26O13/c1-32-12-6-9(4-5-10(12)26)20-23(34-3)17(29)15-13(35-20)7-11(27)21(33-2)22(15)37-24-19(31)18(30)16(28)14(8-25)36-24/h4-7,14,16,18-19,24-28,30-31H,8H2,1-3H3/t14-,16-,18+,19-,24+/m1/s1

> <SMILES>
C1(O)=CC2OC(C3C=C(OC)C(O)=CC=3)=C(OC)C(=O)C=2C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C1OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
162883284

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090; 1434890

> <CITATION>
-

$$$$