LMST02020150
  LIPID_MAPS_STRUCTURE_DATABASE

 25 28  0  0  0  0  0  0  0  0999 V2000
   12.0795   -5.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2134   -5.6990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3474   -5.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4813   -5.6990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6152   -4.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4813   -3.6991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3474   -4.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0795   -2.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2134   -3.6991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2134   -4.6991    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9455   -4.6991    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0795   -4.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0795   -3.1992    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6152   -5.1991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7492   -5.6991    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2134   -2.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3474   -3.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9455   -1.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4844   -3.1992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8966   -4.0081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9455   -3.6991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9455   -2.6992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8966   -2.3901    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2056   -1.4391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3474   -2.1992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 12  1  1  0  0  0  0
 12  9  1  0  0  0  0
 12 21  1  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  7  1  0  0  0  0
  4 14  1  0  0  0  0
 14  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  9  1  0  0  0  0
  9 16  1  0  0  0  0
 16  8  1  0  0  0  0
  8 22  1  0  0  0  0
  9 10  1  6  0  0  0
 21 11  1  6  0  0  0
 12 13  1  1  0  0  0
 14 15  2  0  0  0  0
  7 17  1  1  0  0  0
 22 18  1  1  0  0  0
 23 24  1  1  0  0  0
 19 20  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 19  1  0  0  0  0
 23 22  1  0  0  0  0
 16 25  1  6     0  0
M  END
> <LM_ID>
LMST02020150

> <COMMON_NAME>
11alpha-Hydroxytestosterone

> <SYSTEMATIC_NAME>
11alpha,17beta-dihydroxyandrost-4-en-3-one

> <FORMULA>
C19H28O3

> <MASS>
304.20

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

> <SUB_CLASS>
C19 steroids (androgens) and derivatives [ST0202]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YQDZGFAYWGWSJK-RUOITVIXSA-N

> <INCHI>
InChI=1S/C19H28O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h9,13-17,21-22H,3-8,10H2,1-2H3/t13-,14-,15+,16-,17+,18-,19-/m0/s1

> <SMILES>
C1CC2[C@@](C)([C@@]3([H])[C@H](O)C[C@@]4([C@H](CC[C@@]4([H])[C@]13[H])O)C)CCC(=O)C=2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
79808

> <ABBREVIATION>
ST 19:2;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11954152

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
4830

> <CITATION>
23985409

$$$$