LMST03020413
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    9.3481    6.5699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4658    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5837    6.5699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5837    7.5886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4658    8.0978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4658    9.1606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3172    9.6521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3172   10.6350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4658   11.1266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3481    7.5886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4658   12.1095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3172   12.6010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1683   12.1095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1683   11.1266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8710   11.1266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8710   12.1095    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0197   12.6010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1683   12.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1683   10.3801    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7661   13.0321    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0197   13.5839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8708   14.0753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7221   13.5839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.5733   14.0753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4244   13.5839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2757   14.0753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4244   12.6010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0197   14.5668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0703   13.8384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.0785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1991    8.0800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1992    6.0785    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2757   13.0924    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1268   13.5839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2757   12.1096    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
 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  0  0  0  0
 21 29  1  0  0  0  0
  3 30  1  6  0  0  0
 10 31  2  0  0  0  0
  1 32  1  1  0  0  0
 29 28  1  0  0  0  0
 25 33  1  0  0  0  0
 26 34  1  0  0  0  0
 27 35  1  0  0  0  0
M  END
> <LM_ID>
LMST03020413

> <COMMON_NAME>
1alpha,25-dihydroxy-26,27-dimethyl-20,21-methano-23-oxavitamin D3

> <SYSTEMATIC_NAME>
(5Z,7E)-(1S,3R)-26,27-dimethyl-20,21-methano-23-oxa-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-26,27-dimethyl-20,21-methano-23-oxacholecalciferol

> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9547520

> <LIPIDBANK_ID>
VVD0501

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMST03020413

$$$$