LMST01010522
  LIPID_MAPS_STRUCTURE_DATABASE

 34 37  0     0  0            999 V2000
    8.4989    9.5615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6219    9.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6219    8.0621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3476    8.0621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2151    7.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1015    8.0621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1015    9.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2151    9.5615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3476    9.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2151   10.5422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1015   11.0515    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9502   10.5422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9502    9.5615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9026    9.2502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4684   10.0424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9026   10.8534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9502   11.5701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3476   10.0613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9502    8.5524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7797   11.3438    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3450    7.1172    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    7.5397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6368   11.8813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5039   12.3819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3709   11.8813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3709   10.8801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2381   12.3819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7696   12.3819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9026   11.8813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0356   12.3819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4989    7.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4989    6.5612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6317    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3660    6.0606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 13 12  1  0  0  0  0
 16 12  1  0  0  0  0
 11 12  1  0  0  0  0
 12 17  1  1  0  0  0
  7 13  1  0  0  0  0
 14 13  1  0  0  0  0
 13 19  1  6  0  0  0
 10  8  1  0  0  0  0
  9  8  1  0  0  0  0
  7  8  2  0  0  0  0
  6  7  1  0  0  0  0
  4  9  1  0  0  0  0
  9 18  1  1  0  0  0
  1  9  1  0  0  0  0
 15 16  1  0  0  0  0
 29 16  1  0  0  0  0
 16 20  1  6  0  0  0
 10 11  1  0  0  0  0
 15 14  1  0  0  0  0
  5  6  1  0  0  0  0
 31  4  1  0  0  0  0
  5  4  1  0  0  0  0
  2  1  1  0  0  0  0
  3 31  1  0  0  0  0
  3  2  1  0  0  0  0
  4 21  1  6  0  0  0
  3 22  1  1  0  0  0
 28 23  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  2  0  0  0  0
 26 25  1  0  0  0  0
 27 25  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  6  0  0  0
 31 32  1  6  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
M  END
> <LM_ID>
LMST01010522

> <COMMON_NAME>
4alpha-carboxy-zymosterol

> <SYSTEMATIC_NAME>
4alpha-carboxy-5alpha-cholesta-8,24-dien-3beta-ol

> <FORMULA>
C28H44O3

> <MASS>
428.33

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Cholesterol and derivatives [ST0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
JHIWIFRQJXLNEU-GSQAGGHASA-N

> <INCHI>
InChI=1S/C28H44O3/c1-17(2)7-6-8-18(3)20-11-12-21-19-9-10-23-25(26(30)31)24(29)14-16-28(23,5)22(19)13-15-27(20,21)4/h7,18,20-21,23-25,29H,6,8-16H2,1-5H3,(H,30,31)/t18-,20-,21+,23+,24+,25+,27-,28-/m1/s1

> <SMILES>
C1C[C@H](O)[C@@H](C(O)=O)[C@]2([H])CCC3=C([C@]21C)CC[C@]1(C)[C@@]([H])([C@H](C)CC/C=C(/C)\C)CC[C@]13[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
143575

> <ABBREVIATION>
ST 28:3;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
22298944

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
23583456

$$$$