LMPR0106180003
  LIPID_MAPS_STRUCTURE_DATABASE

 35 39  0  0  0  0  0  0  0  0999 V2000
    6.1472    6.9834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1472    6.1451    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.8732    5.7260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5992    6.1451    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.5992    6.9834    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.8732    7.4026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3252    5.7260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0512    6.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0512    6.9834    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.3252    7.4026    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.7772    7.4026    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.7772    8.2409    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.0512    8.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3252    8.2409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4540    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2923    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5992    7.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0512    7.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5032    6.9834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2292    7.4026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2292    8.2409    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.5032    8.6601    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.9552    8.6601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9552    9.4984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2292    9.9175    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.5032    9.4984    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.7772    8.9919    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5032    8.0485    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7772    9.9175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7772    6.5643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.5524    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2292   10.7558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9552    7.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9552    6.9834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6812    8.2409    0.0000 O   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  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
  9 18  1  1  0  0  0
 11 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 12  1  0  0  0  0
 21 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
 26 22  1  0  0  0  0
 12 27  1  1  0  0  0
 22 28  1  1  0  0  0
 26 29  1  1  0  0  0
 11 30  1  6  0  0  0
  2 31  1  1  0  0  0
 25 32  1  6  0  0  0
 21 33  1  1  0  0  0
 33 34  2  0  0  0  0
 33 35  1  0  0  0  0
M  END
> <LM_ID>
LMPR0106180003

> <COMMON_NAME>
(+)-3beta-Hydroxy-ursan-28-oic acid

> <SYSTEMATIC_NAME>


> <FORMULA>
C30H50O3

> <MASS>
458.38

> <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>
USGWNZHHTABDDB-KZXHQYACSA-N

> <INCHI>
InChI=1S/C30H50O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h18-24,31H,8-17H2,1-7H3,(H,32,33)/t18-,19+,20-,21?,22?,23+,24+,27+,28-,29-,30+/m1/s1

> <SMILES>
C1C[C@]2(C)C3CC[C@]4([H])[C@]5([H])[C@@H](C)[C@H](C)CC[C@]5(C(O)=O)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)[C@H]1O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608294

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$