LMST02020013
  LIPID_MAPS_STRUCTURE_DATABASE

 25 28  0     0  0            999 V2000
    7.8359    8.4358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9374    7.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9374    6.8795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8359    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7343    6.8795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6328    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5316    6.8795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5316    7.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6328    8.4358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7343    7.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6328    9.4733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5316    9.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4299    9.4733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4299    8.4358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2270    8.4358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2270    9.4733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3284    9.9922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4299   10.2775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7343    8.6434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3284   10.7557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2946    6.5085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5316    8.7989    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6133    7.5633    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4299    7.6308    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1916   10.2233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  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
 17 20  1  1  0  0  0
  3 21  2  0  0  0  0
  8 22  1  1  0  0  0
  9 23  1  6  0  0  0
 14 24  1  6  0  0  0
 17 25  1  6  0  0  0
M  END
> <LM_ID>
LMST02020013

> <COMMON_NAME>
Methandrostenolone

> <SYSTEMATIC_NAME>
17beta-hydroxy-17-methylandrosta-1,4-dien-3-one

> <FORMULA>
C20H28O2

> <MASS>
300.21

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Metandienone

> <INCHI_KEY>
XWALNWXLMVGSFR-HLXURNFRSA-N

> <INCHI>
InChI=1S/C20H28O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h6,9,12,15-17,22H,4-5,7-8,10-11H2,1-3H3/t15-,16+,17+,18+,19+,20+/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@](C)(O)CC[C@@]4([H])[C@]3([H])CCC2=CC(=O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0041925

> <CHEBI_ID>
6810

> <ABBREVIATION>
ST 20:3;O2

> <CAYMAN_ID>
21172

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6300

> <LIPIDBANK_ID>
SST0086

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
13849585

$$$$