LMFA05000695
  LIPID_MAPS_STRUCTURE_DATABASE

 31 32  0  0  0  0            999 V2000
    7.6923   -5.7800    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.6923   -6.6050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9777   -5.3675    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.9777   -7.0175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633   -5.7800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633   -6.6050    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.1212   -5.7800    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.1212   -6.6050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4067   -5.3675    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.4067   -7.0175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5488   -7.0175    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8357   -5.3675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6934   -4.9550    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9777   -4.5425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633   -4.1300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2633   -3.3050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5488   -4.5424    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.8343   -4.1299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1199   -4.5424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5487   -5.3674    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4091   -4.5425    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1247   -4.1320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1247   -3.3099    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.8392   -2.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4103   -2.8974    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5537   -3.3099    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   11.2682   -2.8974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5537   -4.1349    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9826   -3.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6971   -2.8975    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9826   -4.1350    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  1  0  0  0  0
  8  7  1  0  0  0  0
  9  7  1  0  0  0  0
 10  8  2  0  0  0  0
  1  9  1  0  0  0  0
  2 10  1  0  0  0  0
  2  1  1  0  0  0  0
  6 11  1  1  0  0  0
  7 12  1  1  0  0  0
  1 13  1  1  0  0  0
  3 14  1  6  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  1  0  0  0
  9 21  1  1  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  1  0  0  0
 24 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  6  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  2  0  0  0  0
M  END
> <LM_ID>
LMFA05000695

> <COMMON_NAME>
Pravastatin

> <SYSTEMATIC_NAME>
(3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylbutanoyl]oxy}-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid

> <FORMULA>
C23H36O7

> <MASS>
424.25

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty alcohols [FA05]

> <SUB_CLASS>
-

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
TUZYXOIXSAXUGO-PZAWKZKUSA-N

> <INCHI>
InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/t13-,14-,16+,17+,18+,19-,20-,22-/m0/s1

> <SMILES>
[C@]12([H])C(C=C[C@H](C)[C@@H]1CC[C@@H](O)C[C@@H](O)CC(=O)O)=C[C@@H](O)C[C@@H]2OC([C@@H](C)CC)=O

> <KEGG_ID>
C01844

> <HMDB_ID>
HMDB0005022

> <CHEBI_ID>
63618

> <ABBREVIATION>
FOH 23:6;O6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
54687

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$