LMST04060006
  LIPID_MAPS_STRUCTURE_DATABASE

 33 36  0     0  0            999 V2000
    8.3597    8.7313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4112    8.1835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4112    7.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3597    6.5405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3083    7.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2569    6.5405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2055    7.0883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2055    8.1835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2569    8.7313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3083    8.1835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2569    9.8266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2055   10.3743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1540    9.8266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1540    8.7313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0512    8.7313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0512    9.8266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1026   10.3743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1540   10.6756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3083    8.9505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1026   11.2505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2106   11.4895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8615   11.6887    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6203   11.2505    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3083    6.3606    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.6966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2055   11.1934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8615   12.3959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6186   10.5108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2055    9.1147    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2362    7.8101    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.1540    7.8814    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7169   10.7289    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1026   12.1849    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
  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 24  1  1  0  0  0
  3 25  1  6  0  0  0
 12 26  1  6  0  0  0
 22 27  1  0  0  0  0
 23 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>
LMST04060006

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
24-Nor-5beta-cholane-3alpha,12alpha,22,23-tetrol

> <FORMULA>
C23H40O4

> <MASS>
380.29

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C23 bile acids, alcohols, and derivatives [ST0406]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MEGHYHKXGSKUIU-FFRQVMGHSA-N

> <INCHI>
InChI=1S/C23H40O4/c1-13(20(26)12-24)17-6-7-18-16-5-4-14-10-15(25)8-9-22(14,2)19(16)11-21(27)23(17,18)3/h13-21,24-27H,4-12H2,1-3H3/t13-,14+,15+,16-,17+,18-,19-,20?,21-,22-,23+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
187012

> <ABBREVIATION>
ST 23:0;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284302

> <LIPIDBANK_ID>
BBA0497

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
3837414

$$$$