LMST04030077
  LIPID_MAPS_STRUCTURE_DATABASE

 36 39  0  0  0  0  0  0  0  0999 V2000
    6.9071    7.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1185    6.6135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1185    5.7029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9071    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6957    5.7029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2731    5.7029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2731    6.6135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    7.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6957    6.6135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4844    7.9794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2731    8.4348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0616    7.9794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0616    7.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6389    7.0689    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6389    7.9794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8503    8.4348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0616    8.6853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6957    7.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8503    9.1633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1087    9.3620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4812    9.5275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1121    9.1633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7430    9.5275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3738    9.1633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0048    9.5275    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3738    8.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3610    8.7297    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8503    9.9401    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.3773    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8642    5.2755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2731    9.1158    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7415   10.0508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2731    7.3876    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4671    6.3030    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0616    6.3623    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  2  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
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  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
 17 28  1  6  0  0  0
 20 29  1  1  0  0  0
  3 30  1  1  0  0  0
  7 31  1  6  0  0  0
 12 32  1  6  0  0  0
 24 33  1  0  0  0  0
  8 34  1  1  0  0  0
  9 35  1  6  0  0  0
 14 36  1  6  0  0  0
M  END
> <LM_ID>
LMST04030077

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5-Cholestene-3beta,7alpha,12alpha,24-tetrol

> <FORMULA>
C27H46O4

> <MASS>
434.34

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Bile acids and derivatives [ST04]

> <SUB_CLASS>
C27 bile acids, alcohols, and derivatives [ST0403]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IQROOGHDKSUPMU-OAWLOEJQSA-N

> <INCHI>
InChI=1S/C27H46O4/c1-15(2)22(29)9-6-16(3)19-7-8-20-25-21(14-24(31)27(19,20)5)26(4)11-10-18(28)12-17(26)13-23(25)30/h13,15-16,18-25,28-31H,6-12,14H2,1-5H3/t16-,18+,19-,20+,21+,22?,23-,24+,25+,26+,27-/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])C[C@H](O)[C@]4(C)[C@@]([H])([C@]([H])(C)CCC(O)C(C)C)CC[C@@]4([H])[C@]3([H])[C@H](O)C=C2C[C@@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
188009

> <ABBREVIATION>
ST 27:1;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5284244

> <LIPIDBANK_ID>
BBA0398

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$