LMPR0106180005
  LIPID_MAPS_STRUCTURE_DATABASE

 33 37  0  0  0  0  0  0  0  0999 V2000
    6.1448    6.9753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1448    6.1404    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8678    5.7230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5908    6.1404    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.5908    6.9753    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.8678    7.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3138    5.7230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0368    6.1404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0368    6.9753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3138    7.3927    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.7598    7.3927    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.7598    8.2276    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.0368    8.6450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3138    8.2276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4503    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2852    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5908    7.8101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4828    6.9753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2059    7.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2059    8.2276    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.4828    8.6450    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.9289    8.6450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9289    9.4799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2059    9.8973    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.4828    9.4799    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.4828    8.0359    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7598    9.8973    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7598    6.5578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.5501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2059   10.7322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9289    7.8101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3138    6.6970    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7598    9.0624    0.0000 C   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  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  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 10  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  5 17  1  1  0  0  0
 11 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 12  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 21  1  0  0  0  0
 21 26  1  1  0  0  0
 25 27  1  1  0  0  0
 11 28  1  1  0  0  0
  2 29  1  1  0  0  0
 24 30  1  6  0  0  0
 20 31  1  1  0  0  0
 10 32  1  6  0  0  0
 12 33  1  6  0  0  0
M  END
> <LM_ID>
LMPR0106180005

> <COMMON_NAME>
(-)-Ilexol

> <SYSTEMATIC_NAME>
(-)-7-baueren-3beta-ol

> <FORMULA>
C30H50O

> <MASS>
426.39

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C30 isoprenoids (triterpenes) [PR0106]

> <CLASS_LEVEL4>
Taraxastane, ursane and bauerane triterpenoids [PR010618]

> <SYNONYMS>


> <INCHI_KEY>
TZVDWGXUGGUMCE-MQXFEUHUSA-N

> <INCHI>
InChI=1S/C30H50O/c1-19-11-14-27(5)17-18-29(7)22-9-10-23-26(3,4)24(31)13-15-28(23,6)21(22)12-16-30(29,8)25(27)20(19)2/h9,19-21,23-25,31H,10-18H2,1-8H3/t19-,20+,21+,23?,24+,25-,27-,28-,29-,30+/m1/s1

> <SMILES>
C1C[C@]2(C)[C@@]3([H])CC[C@@]4(C)[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C)CC[C@]4(C)C3=CCC2C(C)(C)[C@H]1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608295

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$