LMST03020625
  LIPID_MAPS_STRUCTURE_DATABASE

 32 34  0  0  0  0  0  0  0  0999 V2000
    6.2665    6.2384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2665    5.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965    5.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965    6.2384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    6.6512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    7.4734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965    7.8862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965    8.7085    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4114    9.1213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4114    9.9469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965   10.3597    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    9.9469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815    9.1213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1966    8.8662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6819    9.5341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1966   10.2020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1966   11.0276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4816   11.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9116   11.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.0017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4086    5.0017    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4114   10.7725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9116   10.6148    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4114    8.2957    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4086    6.6495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965   11.1852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6965   12.0108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815   12.4236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9815   13.2492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2694   12.0125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2665   12.8364    0.0000 O   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  1  0  0  0  0
  6  1  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  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  1  0  0  0  0
 14  9  1  0  0  0  0
 10 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 11  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  2  0  0  0  0
  2 21  1  6  0  0  0
  4 22  1  1  0  0  0
 17 18  1  1  0  0  0
 11 23  1  1  0  0  0
 17 24  1  6  0  0  0
 10 25  1  6  0  0  0
  5 26  2  0  0  0  0
 23 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
M  END
> <LM_ID>
LMST03020625

> <COMMON_NAME>
18-(3-Hydroxy-3-methylbutyl)-20-methyl-9,10-secopregna-5,7,10(19),20-tetraene-1,3-diol

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-18-(3-hydroxy-3-methyl-butyl)-20-methyl-9,10-seco-5,7,10(19),20-pregnatetraen-1,3-diol

> <FORMULA>
C27H42O3

> <MASS>
414.31

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11101757

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020625

$$$$