LMST02020064
  LIPID_MAPS_STRUCTURE_DATABASE

 25 28  0  0  0  0  0  0  0  0999 V2000
    9.0038    6.4554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3038    6.8543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7002    6.8616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0074    5.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6146    6.4481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2965    7.6631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7038    7.6704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1003    6.8579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3110    5.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6146    5.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9218    6.8434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6109    7.2388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9965    8.0693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4075    8.0766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4898    8.5627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1038    7.6668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9218    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2399    6.4481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4075    8.8637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7894    8.0585    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2399    5.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9965    7.2460    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3038    6.0672    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7002    6.0781    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
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  1  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  1  0  0  0
  8 16  1  0  0  0  0
 10 17  1  0  0  0  0
 11 18  1  0  0  0  0
 14 19  2  0  0  0  0
 16 20  1  6  0  0  0
 17 21  1  0  0  0  0
 21 22  1  1  0  0  0
  7 13  1  0  0  0  0
  9 10  2  0  0  0  0
 14 16  1  0  0  0  0
 18 21  1  0  0  0  0
  1 23  1  1  0  0  0
  2 24  1  6  0  0  0
  3 25  1  6  0  0  0
M  END
> <LM_ID>
LMST02020064

> <COMMON_NAME>
16alpha-Hydroxydehydroepiandrosterone

> <SYSTEMATIC_NAME>
3beta,16alpha-dihydroxy-5-androsten-17-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>
QQIVKFZWLZJXJT-DNKQKWOHSA-N

> <INCHI>
InChI=1S/C19H28O3/c1-18-7-5-12(20)9-11(18)3-4-13-14(18)6-8-19(2)15(13)10-16(21)17(19)22/h3,12-16,20-21H,4-10H2,1-2H3/t12-,13+,14-,15-,16+,18-,19-/m0/s1

> <SMILES>
[C@@]12([H])CC=C3C[C@H](CC[C@]3(C)[C@@]1([H])CC[C@]1(C)C([C@H](O)C[C@@]21[H])=O)O

> <KEGG_ID>
C05139

> <HMDB_ID>
HMDB0000352

> <CHEBI_ID>
27771

> <ABBREVIATION>
ST 19:2;O3

> <CAYMAN_ID>
34116

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
102030

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$