LMST02020006
  LIPID_MAPS_STRUCTURE_DATABASE

 24 27  0  0  0  0  0  0  0  0999 V2000
    6.8144    6.6964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0797    6.2722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0797    5.4242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8144    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5489    5.4242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2834    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0180    5.4242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0180    6.2722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2834    6.6964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5489    6.2722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2834    7.5445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0180    7.9687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7524    7.5445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7524    6.6964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2215    6.6964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2215    7.5445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4870    7.9687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7524    8.2020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5489    6.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.1209    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8621    7.9144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0180    6.9933    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2674    5.9830    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7524    6.0382    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 11  1  0  0  0  0
 11 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 16  1  0  0  0  0
 16 17  1  0  0  0  0
  1 10  1  0  0  0  0
  5 10  1  0  0  0  0
  9 10  1  0  0  0  0
  8 14  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  1  0  0  0
 10 19  1  1  0  0  0
  3 20  1  1  0  0  0
 16 21  1  6  0  0  0
  8 22  1  1  0  0  0
  9 23  1  6  0  0  0
 14 24  1  6  0  0  0
M  END
> <LM_ID>
LMST02020006

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
androst-5-en-3beta,16alpha-diol

> <FORMULA>
C19H30O2

> <MASS>
290.22

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CVCDJRPXEWJAAY-UVSUZTNJSA-N

> <INCHI>
InChI=1S/C19H30O2/c1-18-7-6-16-15(17(18)10-14(21)11-18)4-3-12-9-13(20)5-8-19(12,16)2/h3,13-17,20-21H,4-11H2,1-2H3/t13-,14+,15+,16-,17-,18+,19-/m0/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)C[C@H](O)C[C@@]4([H])[C@]3([H])CC=C2C[C@@H](O)C1

> <KEGG_ID>
C14631

> <HMDB_ID>
-

> <CHEBI_ID>
34452

> <ABBREVIATION>
ST 19:1;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
19274

> <LIPIDBANK_ID>
SST0027

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$