LMST02020151
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0  0  0  0  0  0  0  0999 V2000
   12.4292   -8.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5631   -9.0674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6971   -8.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8310   -9.0674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9649   -7.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8310   -7.0675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6971   -7.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4292   -5.5676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5631   -7.0675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5631   -8.0675    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2952   -8.0675    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.4292   -7.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4292   -6.5676    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9649   -8.5675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0989   -9.0675    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5631   -6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6971   -6.5676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2952   -5.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8342   -6.5676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2463   -7.3765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2952   -7.0675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2952   -6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2463   -5.7585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5553   -4.8075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6971   -5.5676    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5631  -10.0674    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
  2 26  1  1     0  0
M  END
> <LM_ID>
LMST02020151

> <COMMON_NAME>
6beta,11alpha-Dihydroxytestosterone

> <SYSTEMATIC_NAME>
6beta,11alpha,17beta-trihydroxyandrost-4-en-3-one

> <FORMULA>
C19H28O4

> <MASS>
320.20

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RXPVSQHVUJODFB-VYVKYUHFSA-N

> <INCHI>
InChI=1S/C19H28O4/c1-18-6-5-10(20)7-13(18)14(21)8-11-12-3-4-16(23)19(12,2)9-15(22)17(11)18/h7,11-12,14-17,21-23H,3-6,8-9H2,1-2H3/t11-,12-,14+,15+,16-,17+,18-,19-/m0/s1

> <SMILES>
C1[C@@H](O)C2[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>
-

> <ABBREVIATION>
ST 19:2;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
57896250

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
4830

> <CITATION>
23985409

$$$$