LMST03020412
  LIPID_MAPS_STRUCTURE_DATABASE

 37 40  0     0  0            999 V2000
    9.3504    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4675    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5845    6.8705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5845    7.8900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4675    8.3997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4675    9.4633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3195    9.9553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3195   10.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4675   11.4311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3504    7.8900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4675   12.4149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3195   12.9068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1713   12.4149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1713   11.4311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8754   11.4311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8754   12.4149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0235   12.9068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1713   13.1773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1713   10.6838    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7706   13.3383    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0235   13.8905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8754   14.3824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7274   13.8905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5794   14.3824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4312   13.8905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2831   14.3824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4312   12.9068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0235   14.8743    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0733   14.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.3786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2022    8.3818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2831   13.3988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6154   12.9066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3609   13.8569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6318   12.9066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2022    6.3786    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1236   12.0546    0.0000 H   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  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  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
  8 14  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  1  0  0  0
 14 19  1  6  0  0  0
 17 20  1  6  0  0  0
 17 21  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 25 27  1  0  0  0  0
 21 28  1  1  0  0  0
 21 29  1  6  0  0  0
  3 30  1  6  0  0  0
 10 31  2  0  0  0  0
 25 32  1  0  0  0  0
 11 33  1  6  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 34 35  1  0  0  0  0
  1 36  1  1  0  0  0
 33 37  1  1  0  0  0
M  END
> <LM_ID>
LMST03020412

> <COMMON_NAME>
1alpha,25-dihydroxy-11alpha-[(1S)-oxiranyl]vitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R,11S)-11-[(1S)-oxiranyl]-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol

> <FORMULA>
C29H46O4

> <MASS>
458.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha,25-dihydroxy-11alpha-[(1S)-oxiranyl]cholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11973054

> <LIPIDBANK_ID>
VVD0500

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020412

$$$$