LMPK12140435
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    9.0909    6.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8136    5.8339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5364    6.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5364    7.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8136    7.5029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0909    7.0857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2591    5.8339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9818    6.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9818    7.0857    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.2591    7.5029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2591    5.1068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8136    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3878    7.4915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7862    7.5011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5197    7.0775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2533    7.5011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2533    8.3482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5197    8.7718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7862    8.3482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7328    8.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6851    7.6899    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.1626    7.0597    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.8501    7.3271    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.5136    7.3343    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.0314    7.8165    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3292    7.5642    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0000    7.5064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7119    6.4666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2441    6.6658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8991    7.9943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2582    9.3345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5197    9.6062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7213   10.2999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 30 31  1  0  0  0  0
 32 33  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  4  1  0  0  0  0
  7 11  2  0  0  0  0
  2 12  1  0  0  0  0
  6 13  1  0  0  0  0
  9 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 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
 17 20  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 24 23  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 21  1  0  0  0  0
 21 27  1  0  0  0  0
 22 28  1  0  0  0  0
 23 29  1  0  0  0  0
 24 13  1  0  0  0  0
 18 32  1  0  0  0  0
 26 30  1  0  0  0  0
M  END
> <LM_ID>
LMPK12140435

> <COMMON_NAME>
Viscumiside A

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H24O11

> <MASS>
464.13

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Flavonoids [PK12]

> <SUB_CLASS>
Flavanones [PK1214]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KZQCCKUDYVSOLC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C22H24O11/c1-30-15-4-9(2-3-11(15)24)14-7-13(26)18-12(25)5-10(6-16(18)32-14)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-6,14,17,19-25,27-29H,7-8H2,1H3

> <SMILES>
C1C(OC2OC(CO)C(O)C(O)C2O)=CC2OC(C3C=C(OC)C(O)=CC=3)CC(=O)C=2C=1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14035424

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
33090

> <CITATION>
-

$$$$