LMST03020113
  LIPID_MAPS_STRUCTURE_DATABASE

 33 35  0     0  0            999 V2000
    9.2729    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3803    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4879    6.8759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4879    7.9065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3803    8.4218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3803    9.4969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2416    9.9942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2416   10.9886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3803   11.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2729    7.9065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3803   12.4803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2416   12.9775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1027   12.4803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1027   11.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8253   11.4859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8253   12.4803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9641   12.9775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1027   13.2510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0281    8.3425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.4398    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1027   10.7306    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7192   13.4137    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9641   13.9720    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8252   14.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9641   14.9663    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0036   14.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8196   14.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8139   14.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8083   14.4691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8083   13.4748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6694   14.9663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6694   13.9720    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1339    6.3787    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  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
 24 23  1  0  0  0  0
 23 25  1  1  0  0  0
 23 26  1  6  0  0  0
 24 27  1  0  0  0  0
 27 28  3  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
  1 33  1  1  0  0  0
M  END
> <LM_ID>
LMST03020113

> <COMMON_NAME>
1alpha,25-dihydroxy-23,23,24,24-tetradehydrovitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol

> <FORMULA>
C27H40O3

> <MASS>
412.30

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Secosteroids [ST03]

> <SUB_CLASS>
Vitamin D3 and derivatives [ST0302]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
1alpha,25-dihydroxy-23,23,24,24-tetradehydrocholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547359

> <LIPIDBANK_ID>
VVD0128

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020113

$$$$