LMPK12010429
  LIPID_MAPS_STRUCTURE_DATABASE

 44 48  0     0  0            999 V2000
    7.3298   10.9248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3298    9.8945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2220    9.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1143    9.8945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1143   10.9248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2220   11.4400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0063    9.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8986    9.8945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8986   10.9248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0063   11.4400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7904   11.4395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6997   10.9147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6092   11.4395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6092   12.4896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6997   13.0147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7904   12.4896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4379   11.4395    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5182   13.0144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2220    8.3496    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9139    9.3670    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6997   14.0644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5182   10.9148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4379    9.3796    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4193   10.4260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1540    9.6170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3182    7.7145    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8025    7.9703    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9245    6.1340    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7176    8.9259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5012    9.4747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3704    9.0681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4522    8.1169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6685    7.5680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7504    6.6168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1035    4.4053    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1955    4.2520    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1133    5.8253    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4271    6.8452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9729    6.0563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5623    5.1919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6060    5.1164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0649    5.9031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4755    6.7673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9343    7.5540    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
  1 17  1  0  0  0  0
 14 18  1  0  0  0  0
  3 19  1  0  0  0  0
 20  8  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
 30 24  1  6     0  0
 31 25  1  1     0  0
 32 26  1  6     0  0
 43 38  1  0     0  0
 38 39  1  0     0  0
 39 40  1  0     0  0
 40 41  1  0     0  0
 41 42  1  0     0  0
 42 43  1  0     0  0
 43 44  1  6     0  0
 39 28  1  1     0  0
 40 35  1  6     0  0
 41 36  1  6     0  0
 42 37  1  1     0  0
 29 20  1  1     0  0
M  CHG  1  10   1
M  END
> <LM_ID>
LMPK12010429

> <COMMON_NAME>
6-Hydroxydelphinidin 3-rutinoside

> <SYSTEMATIC_NAME>
3',4',5,5',6,7-Hexahydroxy-3-[[6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]flavylium

> <FORMULA>
C27H31O17

> <MASS>
627.16

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Anthocyanidins [PK1201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
FL7AEGGL0001

> <PUBCHEM_COMPOUND_ID>
101696908

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK12010429

$$$$