LMST04010142
  LIPID_MAPS_STRUCTURE_DATABASE

 31 34  0  0  0  0  0  0  0  0999 V2000
    5.7702    7.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.7277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7702    5.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5405    5.8384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3107    5.3936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0811    5.8384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0811    6.7277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3107    7.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5405    6.7277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3107    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0811    8.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8512    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8512    7.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3918    7.1725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3918    8.0619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6216    8.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8512    8.7513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5405    7.3505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6216    9.2182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8973    9.4122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2378    9.5739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8540    9.2182    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4702    9.5739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5405    5.2475    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.4702   10.1928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0863    9.2182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0811    7.4839    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8512    6.4824    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1204    8.7946    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6216    9.9769    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  2  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
  8 28  1  1  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>
LMST04010142

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5beta-Chol-9(11)-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>
FHWJRVFVJIUARH-JTRWTHHWSA-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/h13,16-20H,4-12,14-15H2,1-3H3,(H,25,26)/t16-,17+,18+,19-,20+,23+,24-/m1/s1

> <SMILES>
C1[C@]2(C)C3=CC[C@]4(C)[C@@]([H])([C@]([H])(C)CCC(O)=O)CC[C@@]4([H])[C@]3([H])CC[C@]2([H])CCC1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 24:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5283918

> <LIPIDBANK_ID>
BBA0142

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$