LMST03020638
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0  0  0  0  0  0  0  0999 V2000
    7.6967    8.7122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4118    9.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4118    9.9507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6967   10.3635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816    9.9507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816    9.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1970    8.8699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6824    9.5378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1970   10.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4118   10.7764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1970   11.0315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9091   11.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6242   11.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3392   11.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0543   11.0298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6967    7.8899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4849   11.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7694   11.4427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0543   10.2075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9945   10.4195    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4118    8.2994    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816    7.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816    6.6514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2666    6.2385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2666    5.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9816    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6967    5.4128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6967    6.2385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4089    6.6497    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
   11.3392   12.2650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3392   10.6170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7521   12.9801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9264   12.9801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1970   11.8572    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4089    5.0017    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
  2  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  3  1  0  0  0  0
  3 10  1  1  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
  1 16  2  0  0  0  0
 11 17  1  6  0  0  0
 15 18  1  0  0  0  0
 15 19  1  0  0  0  0
  9 20  1  6  0  0  0
  2 21  1  6  0  0  0
 16 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 23  1  0  0  0  0
 28 29  2  0  0  0  0
 25 30  1  6  0  0  0
 14 31  1  0  0  0  0
 14 32  1  0  0  0  0
 31 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 31  1  0  0  0  0
 11 35  1  1  0  0  0
 27 36  1  1  0  0  0
M  END
> <LM_ID>
LMST03020638

> <COMMON_NAME>
1alpha,24-Dihydroxy-22-ene-24-cyclopropylvitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E,22E)-(1S,3R)-24-cyclopropyl-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,24-triol

> <FORMULA>
C30H46O3

> <MASS>
454.34

> <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>
190320

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
24779634

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020638

$$$$