LMPK07000001
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0  0  0  0  0  0  0  0999 V2000
    9.2967    7.1011    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.3140    6.2781    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.0182    7.5037    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.5894    7.5211    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.5720    5.8719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9938    5.8544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7219    7.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8680    7.1150    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.8611    6.2886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5685    5.0420    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7150    6.2571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0273    5.0245    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4505    7.4827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1538    7.5318    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.1468    5.8755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4259    5.8299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4393    7.1219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4358    6.2921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1468    5.0491    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1508    6.2360    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.4431    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7143    7.5353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7179    5.8790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.1185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.2886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7179    5.0491    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1412    8.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0162    8.3223    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7485    8.7293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2976    8.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2898    7.9422    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8639    7.9550    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5676    8.3650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2814    5.4416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 11 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 15 19  2  0  0  0  0
 16 20  1  0  0  0  0
 16 21  2  0  0  0  0
 17 22  1  0  0  0  0
 18 23  1  0  0  0  0
 22 24  2  0  0  0  0
 23 25  2  0  0  0  0
 23 26  1  0  0  0  0
  7 11  2  0  0  0  0
  8  9  1  0  0  0  0
 17 18  2  0  0  0  0
 24 25  1  0  0  0  0
 14 27  1  6  0  0  0
  3 28  1  6  0  0  0
  1  2  1  0  0  0  0
 28 29  1  0  0  0  0
  1  3  1  0  0  0  0
 28 30  1  0  0  0  0
  1  4  1  0  0  0  0
  1 31  1  6  0  0  0
  2  5  1  0  0  0  0
  8 32  1  6  0  0  0
  2  6  1  0  0  0  0
  4 33  1  6  0  0  0
  3  7  1  0  0  0  0
  2 34  1  6  0  0  0
  4  8  1  0  0  0  0
M  END
> <LM_ID>
LMPK07000001

> <COMMON_NAME>
Doxycycline

> <SYSTEMATIC_NAME>


> <FORMULA>
C22H24N2O8

> <MASS>
444.15

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Linear tetracyclines [PK07]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C06973

> <HMDB_ID>
HMDB0014399

> <YMDB_ID>
-

> <CHEBI_ID>
50845

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
54671203

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPK07000001

$$$$