LMST02010041
  LIPID_MAPS_STRUCTURE_DATABASE

 24 27  0  0  0  0  0  0  0  0999 V2000
    6.2689    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2689    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9834    6.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9834    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6978    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4123    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1268    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1268    6.4850    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.8412    6.8975    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.6259    6.6426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1108    7.3100    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.6259    7.9775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8808    8.7621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8412    7.7225    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.8412    8.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1268    8.1350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4123    7.7225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4123    6.8975    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.6978    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9358    7.3100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4123    6.0725    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1268    7.3100    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8412    6.0725    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
  3  4  2  0  0  0  0
  1  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 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 10 15  1  0  0  0  0
 15 16  1  1  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
  9 19  1  0  0  0  0
 19 20  1  0  0  0  0
  4 20  1  0  0  0  0
  6 20  2  0  0  0  0
 12 21  1  6  0  0  0
 19 22  1  6  0  0  0
  9 23  1  1  0  0  0
 10 24  1  6  0  0  0
M  END
> <LM_ID>
LMST02010041

> <COMMON_NAME>
16alpha-hydroxyestrone

> <SYSTEMATIC_NAME>
3,16alpha-dihydroxy-1,3,5(10)-estratrien-17-one

> <FORMULA>
C18H22O3

> <MASS>
286.16

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1.16a-Hydroxyestrone

> <KEGG_ID>
C05300

> <HMDB_ID>
HMDB0000335

> <YMDB_ID>
-

> <CHEBI_ID>
776

> <CAYMAN_ID>
15208

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
SLM:000485703

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
115116

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST02010041

$$$$