LMPK15050006
  LIPID_MAPS_STRUCTURE_DATABASE

 21 21  0     0  0            999 V2000
   -0.9556    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9556   -0.1085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0784   -0.6149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7986   -0.1085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7986    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0784    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0634   -1.4107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6970    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6970    1.3601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5805    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4643    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3482    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2321    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1159    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9998    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8837    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7676    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6515    0.9042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5352    1.4107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0784    2.4136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6647   -0.6085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  1  0     0  0
  3  7  2  0     0  0
  5  8  1  0     0  0
  1  9  1  0     0  0
  8 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
  6 20  2  0     0  0
  4 21  1  0     0  0
M  END
> <LM_ID>
LMPK15050006

> <COMMON_NAME>
Embelin

> <SYSTEMATIC_NAME>
2,5-dihydroxy-3-undecyl-1,4-benzoquinone

> <FORMULA>
C17H26O4

> <MASS>
294.18

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl hydroquinones and derivatives [PK1505]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C10342

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
4778

> <CAYMAN_ID>
11838

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
3218

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK15050006

$$$$