LMPR0106200008
  LIPID_MAPS_STRUCTURE_DATABASE

 34 38  0     0  0            999 V2000
    7.6117    8.4624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6117    7.4473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4909    6.9397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3700    7.4473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3700    8.4624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4909    8.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2492    6.9397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1284    7.4473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1284    8.4624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2492    8.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0075    8.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0075    9.9852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1284   10.4928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2492    9.9852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9833    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9984    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3700    9.4776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8867    8.4624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7658    8.9701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7658    9.9852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8867   10.4928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0075    7.9548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5203   10.6645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1073   11.5919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0977   11.4857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5132   10.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8269    9.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1925   11.2078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7658   10.6929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0075   11.0004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7325    6.9397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8867    9.6045    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1284    9.4624    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4038    6.7814    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  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  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  2  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
 11 22  1  6  0  0  0
 20 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
 23 26  1  1  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 20 29  1  1  0  0  0
 12 30  1  1  0  0  0
  2 31  1  6  0  0  0
 21 32  1  6  0  0  0
  9 33  1  1     0  0
  4 34  1  6     0  0
M  END
> <LM_ID>
LMPR0106200008

> <COMMON_NAME>
Arborinol

> <SYSTEMATIC_NAME>


> <FORMULA>
C30H50O

> <MASS>
426.39

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Neohopane, fernane, adianane and filicane triterpenoids [PR010620]

> <SYNONYMS>


> <INCHI_KEY>
VWYANPOOORUCFJ-CFHAFXOMSA-N

> <INCHI>
InChI=1S/C30H50O/c1-19(2)20-9-12-24-28(20,6)17-18-29(7)22-10-11-23-26(3,4)25(31)14-15-27(23,5)21(22)13-16-30(24,29)8/h13,19-20,22-25,31H,9-12,14-18H2,1-8H3/t20-,22+,23-,24-,25+,27+,28-,29-,30+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12305177

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
76967

> <CITATION>
5852037

$$$$