LMST02030104
  LIPID_MAPS_STRUCTURE_DATABASE

 27 30  0     0  0            999 V2000
   10.2791    9.0520    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2708    8.0839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1262    9.5276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4447    9.5402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3001    9.9699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4280    7.5999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9481    8.0631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9607    9.0311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0233   10.1202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1388   10.4999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5976    9.0646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5114   10.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5934    8.0922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4280    6.6278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9246   10.7168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7630    9.5570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7463    7.6082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5851    6.1436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7423    6.6361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9076    8.0965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9076    6.1479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.6082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.6361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2457    7.1159    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3652    8.5388    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5808    7.1159    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7423    8.6430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  1  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  1  0  0  0  0
  3  9  1  6  0  0  0
  3 10  1  1  0  0  0
  4 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  9 15  3  0  0  0  0
 11 16  2  0  0  0  0
 13 17  1  0  0  0  0
 14 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
 19 21  2  0  0  0  0
 20 22  1  0  0  0  0
 21 23  1  0  0  0  0
  7  8  1  0  0  0  0
 11 13  1  0  0  0  0
 18 19  1  0  0  0  0
 22 23  1  0  0  0  0
  2 24  1  6  0  0  0
  6 25  1  1  0  0  0
 13 26  1  6  0  0  0
 17 27  1  1  0  0  0
M  END
> <LM_ID>
LMST02030104

> <COMMON_NAME>
Desogestrel

> <SYSTEMATIC_NAME>
13-ethyl-11-methylene-18,19-dinorpregn-4-en-20-yn-17alpha-ol

> <FORMULA>
C22H30O

> <MASS>
310.23

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

> <SUB_CLASS>
C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives [ST0203]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
C07629

> <HMDB_ID>
HMDB0014449

> <YMDB_ID>
-

> <CHEBI_ID>
4453

> <CAYMAN_ID>
23651

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
40973

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://dev.lipidmaps.org/databases/lmsd/LMST02030104

$$$$