LMST04030032
  LIPID_MAPS_STRUCTURE_DATABASE

 38 41  0  0  0  0  0  0  0  0999 V2000
    6.9147    7.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1217    6.7715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1217    5.8558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9147    5.3979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7077    5.8558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5008    5.3979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2939    5.8558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2939    6.7715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5008    7.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7077    6.7715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5008    8.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2939    8.6031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0868    8.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0868    7.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6730    7.2295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6730    8.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8800    8.6031    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0868    8.8549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7077    7.4127    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8800    9.3356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1342    9.5354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5144    9.7019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1488    9.3356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7832    9.7019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4175    9.3356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0521    9.7019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4175    8.7172    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3935    8.8995    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8800   10.1168    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7077    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.5284    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8884    5.4261    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2939    9.2879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5144   10.2932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0535    8.8562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2939    7.5500    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4834    6.4593    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0868    6.5189    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  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  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
 17 20  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  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
 25 27  1  0  0  0  0
  1 10  1  0  0  0  0
  5 10  1  0  0  0  0
  9 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  1  1  0  0  0
 20 21  1  6  0  0  0
 17 28  1  6  0  0  0
 20 29  1  1  0  0  0
  5 30  1  1  0  0  0
  3 31  1  6  0  0  0
  7 32  1  6  0  0  0
 12 33  1  6  0  0  0
 22 34  1  0  0  0  0
 25 35  1  0  0  0  0
  8 36  1  1  0  0  0
  9 37  1  6  0  0  0
 14 38  1  6  0  0  0
M  END
> <LM_ID>
LMST04030032

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5beta-Cholestane-3alpha,7alpha,12alpha,22,25-pentol

> <FORMULA>
C27H48O5

> <MASS>
452.35

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C27 bile acids, alcohols, and derivatives [ST0403]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PPPJDFCEPHGXCD-YGFSCYPHSA-N

> <INCHI>
InChI=1S/C27H48O5/c1-15(21(29)9-10-25(2,3)32)18-6-7-19-24-20(14-23(31)27(18,19)5)26(4)11-8-17(28)12-16(26)13-22(24)30/h15-24,28-32H,6-14H2,1-5H3/t15-,16-,17+,18+,19-,20-,21?,22+,23-,24-,26-,27+/m0/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@@]([H])([C@]([H])(C)C(O)CCC(O)(C)C)CC[C@@]4([H])[C@]3([H])[C@H](O)C[C@]2([H])C[C@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 27:0;O5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284207

> <LIPIDBANK_ID>
BBA0340

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$