LMST02030201
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0     0  0            999 V2000
   10.4917    7.5192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4861    9.4767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6390    8.9826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6475    8.0044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3427    8.9924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3393    8.0132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0340    8.0073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0376    8.9865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1918    9.4820    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3118   10.0350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1813   10.4340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8053    7.5192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8053    6.5457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6475    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4917    6.5457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9683    8.0025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1314    7.5192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1314    6.5531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9683    6.0698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8053    8.4855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2945    6.0698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0245   10.9208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6475    7.0309    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.3393    7.0396    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4917    8.4929    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0350    9.9688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  5  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  6  7  1  0  0  0  0
  5 10  1  1  0  0  0
  9 11  1  6  0  0  0
  4 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15  1  1  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 13  2  0  0  0  0
 12 20  1  1  0  0  0
 18 21  2  0  0  0  0
 11 22  1  0  0  0  0
  4 23  1  6  0  0  0
  6 24  1  6  0  0  0
  1 25  1  1  0  0  0
  9 26  1  1  0  0  0
M  END
> <LM_ID>
LMST02030201

> <COMMON_NAME>
Ethyltestosterone

> <SYSTEMATIC_NAME>
17beta-hydroxy-pregn-4-en-3-one

> <FORMULA>
C21H32O2

> <MASS>
316.24

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
FGPGANCDNDLUST-CEGNMAFCSA-N

> <INCHI>
InChI=1S/C21H32O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h13,16-18,23H,4-12H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1

> <SMILES>
[C@@]12([H])CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@](O)(CC)CC[C@@]21[H]

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0006002

> <CHEBI_ID>
166780

> <ABBREVIATION>
ST 21:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
13908542

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
-

$$$$