LMPK12010431
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
    7.5757   10.9989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5757    9.9665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4698    9.4504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3637    9.9665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3637   10.9989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4698   11.5151    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2578    9.4504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1520    9.9665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1520   10.9989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2578   11.5151    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1236   11.5598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0177   11.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9116   11.5598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9116   12.5922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0177   13.1084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1236   12.5922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7127   13.0548    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2261    9.3462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8499   11.4179    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4698    8.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0177   14.0234    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7437   11.0795    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.4797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.6313    7.9210    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0994    5.9913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1663    5.4905    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9916    8.1290    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6723    5.9192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9621    8.3832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6646    7.6707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3968    6.7038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4303    6.4535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7277    7.1661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7611    6.9157    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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  9 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
 14 17  1  0  0  0  0
  8 18  1  0  0  0  0
  1 19  1  0  0  0  0
  3 20  1  0  0  0  0
 15 21  1  0  0  0  0
 13 22  1  0  0  0  0
  2 23  1  0  0  0  0
 28 34  1  0     0  0
 33 27  1  0     0  0
 27 29  1  0     0  0
 29 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  1     0  0
 29 18  1  1     0  0
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  6     0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010431

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
6-Hydroxydelphinidin 3-glucoside

> <FORMULA>
C21H21O13

> <MASS>
481.10

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AHZRLDWIGPWRSX-WXPOUNOZSA-O

> <INCHI>
InChI=1S/C21H20O13/c22-5-13-17(29)18(30)19(31)21(34-13)33-12-3-7-11(4-10(25)16(28)14(7)26)32-20(12)6-1-8(23)15(27)9(24)2-6/h1-4,13,17-19,21-22,29-31H,5H2,(H5-,23,24,25,26,27,28)/p+1/t13-,17-,18+,19-,21-/m1/s1

> <SMILES>
C1(O)=CC2[O+]=C(C3C=C(O)C(O)=C(O)C=3)C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)=CC=2C(O)=C1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101192439

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$