LMST04010267
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0  0  0  0  0  0  0  0999 V2000
    5.7705    7.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7705    5.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5409    5.8385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3114    5.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0820    5.8385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0820    6.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3114    7.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5409    6.7281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3114    8.0627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0820    8.5076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8523    8.0627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8523    7.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3933    7.1731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3933    8.0627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6229    8.5076    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8523    8.7523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5409    7.3511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6229    9.2193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8984    9.4134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2393    9.5751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8556    9.2193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4720    9.5751    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5409    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4720   10.1942    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0883    9.2193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2946    6.4248    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8523    6.4827    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1218    8.7956    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6229    9.9782    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  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
 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
  5 25  1  1  0  0  0
 24 26  2  0  0  0  0
 24 27  1  0  0  0  0
  9 28  1  6  0  0  0
 14 29  1  6  0  0  0
 17 30  1  6  0  0  0
 20 31  1  1  0  0  0
M  END
> <LM_ID>
LMST04010267

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5beta-Chol-7-en-24-oic Acid

> <FORMULA>
C24H38O2

> <MASS>
358.29

> <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>
SKQYGCRUIVNLNN-FTLZCDAUSA-N

> <INCHI>
InChI=1S/C24H38O2/c1-16(7-12-22(25)26)19-10-11-20-18-9-8-17-6-4-5-14-23(17,2)21(18)13-15-24(19,20)3/h9,16-17,19-21H,4-8,10-15H2,1-3H3,(H,25,26)/t16-,17+,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])C3=CC[C@]2([H])CCC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 24:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284020

> <LIPIDBANK_ID>
BBA0267

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$