LMST03020483
  LIPID_MAPS_STRUCTURE_DATABASE

 37 39  0     0  0            999 V2000
    9.2744    6.5763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3814    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4883    6.5763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4883    7.6075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3814    8.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3814    9.1988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2431    9.6965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2431   10.6914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3814   11.1891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2744    7.6075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3814   12.1840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2431   12.6816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1047   12.1840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1047   11.1891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8284   11.1891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8284   12.1840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9667   12.6816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1047   12.9553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0302    8.0437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.1400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1047   10.4333    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7223   13.1180    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9667   13.6767    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1360    6.0789    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8283   14.1741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6900   14.6716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5506   15.1690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4124   14.6721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2738   15.1699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1356   14.6729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0056   13.9341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9667   14.6716    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.1356   13.6779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9973   15.1704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9973   14.1753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8590   14.6729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9973   13.1804    0.0000 C   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
 10 19  2  0  0  0  0
  3 20  1  6  0  0  0
 14 21  1  6  0  0  0
 17 22  1  6  0  0  0
 17 23  1  0  0  0  0
  1 24  1  1  0  0  0
 23 25  1  0  0  0  0
 25 26  3  0  0  0  0
 26 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
 23 31  1  6  0  0  0
 23 32  1  1  0  0  0
 30 33  1  0  0  0  0
 30 34  1  0  0  0  0
 30 35  1  0  0  0  0
 34 36  1  0  0  0  0
 33 37  1  0  0  0  0
M  END
> <LM_ID>
LMST03020483

> <COMMON_NAME>
1alpha,25-dihydroxy-26,27-dimethyl-22,22,23,23-tetradehydro-24a,24b-dihomovitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatrien-22-yne-1,3,25-triol

> <FORMULA>
C31H48O3

> <MASS>
468.36

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha,25-dihydroxy-26,27-dimethyl-22,22,23,23-tetradehydro-24a,24b-dihomocholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547587

> <LIPIDBANK_ID>
VVD0573

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020483

$$$$