LMST02010050
  LIPID_MAPS_STRUCTURE_DATABASE

 24 27  0  0  0  0  0  0  0  0999 V2000
    9.0102    6.4486    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0057    8.0603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3081    7.6535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3152    6.8481    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.7110    7.6616    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7081    6.8553    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.1036    6.8505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1066    7.6567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4101    8.0647    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6855    8.5200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4015    8.8485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6216    6.4486    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.6216    5.6469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3152    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0102    5.6469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9325    6.8465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2434    6.4486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2434    5.6530    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.9325    5.2551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6216    7.2443    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2551    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3152    6.0464    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7081    6.0536    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0102    7.2503    0.0000 H   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  1  0  0  0
  4 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  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  1  0  0  0  0
 12 20  1  1  0  0  0
 18 21  1  1  0  0  0
  4 22  1  6  0  0  0
  6 23  1  6  0  0  0
  1 24  1  1  0  0  0
M  END
> <LM_ID>
LMST02010050

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
19-Nor-5-androstenediol

> <FORMULA>
C18H28O2

> <MASS>
276.21

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

> <SUB_CLASS>
C18 steroids (estrogens) and derivatives [ST0201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
VVUQRXPUVKXAIO-XFUVECHXSA-N

> <INCHI>
InChI=1S/C18H28O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h2,12-17,19-20H,3-10H2,1H3/t12-,13-,14+,15+,16-,17-,18-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0004590

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 18:1;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9900246

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$