LMST04010334
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0  0  0  0  0  0  0  0999 V2000
    6.8875    7.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1103    6.7411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1103    5.8437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8875    5.3949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6647    5.8437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4419    5.3949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2192    5.8437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2192    6.7411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4419    7.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6647    6.7411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4419    8.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2192    8.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9963    8.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9963    7.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5508    7.1899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5508    8.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7736    8.5361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9963    8.7829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6647    7.3695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7736    9.2540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0428    9.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3954    9.6130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0172    9.2540    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6389    9.6130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.5228    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6647    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6389   10.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.2606    9.2540    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2192    7.5040    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4250    6.4351    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9963    6.4935    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.2769    8.8266    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7736   10.0196    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  2  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
  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
  3 25  1  6  0  0  0
  5 26  1  6  0  0  0
 24 27  2  0  0  0  0
 24 28  1  0  0  0  0
  8 29  1  1  0  0  0
  9 30  1  6  0  0  0
 14 31  1  6  0  0  0
 17 32  1  6  0  0  0
 20 33  1  1  0  0  0
M  END
> <LM_ID>
LMST04010334

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
3alpha-Hydroxy-5alpha-chol-6-en-24-oic Acid

> <FORMULA>
C24H38O3

> <MASS>
374.28

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C24 bile acids, alcohols, and derivatives [ST0401]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AZFLHSKQKSZOET-NWFSOSCSSA-N

> <INCHI>
InChI=1S/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h5-6,15-21,25H,4,7-14H2,1-3H3,(H,26,27)/t15-,16+,17-,18+,19-,20+,21+,23+,24-/m1/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 24:2;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284081

> <LIPIDBANK_ID>
BBA0618

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$