LMPR04000022
  LIPID_MAPS_STRUCTURE_DATABASE

 38 43  0  0  0  0  0  0  0  0999 V2000
    5.0000    6.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7028    5.4051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4057    5.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4057    6.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7028    7.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1084    5.4051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8113    5.8108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8113    6.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1084    7.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5141    7.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5141    7.8397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8113    8.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1084    7.8397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2169    6.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9197    7.0281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2169    8.2455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2160    9.0570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9197    7.8397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6231    8.2469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6222    9.0585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4057    7.4325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8113    7.4325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4044    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0012    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5141    6.2180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2169    7.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7308    7.8426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4324    8.2477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4324    9.0589    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2034    7.9984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6807    8.6547    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2034    9.3111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4542    7.2280    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4908    8.6547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3252    7.0325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3252    7.8426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0280    8.2484    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  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
 11 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 19  1  0  0  0  0
 17 12  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 18 21  1  0  0  0  0
  5 22  1  1  0  0  0
  9 23  1  1  0  0  0
  3 24  1  0  0  0  0
  3 25  1  0  0  0  0
 11 26  1  6  0  0  0
 17 27  1  6  0  0  0
 37 20  1  6  0  0  0
 28 38  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 30 33  1  0  0  0  0
 31 34  1  6  0  0  0
 32 35  1  6  0  0  0
 37 36  1  0  0  0  0
 38 37  1  0  0  0  0
M  END
> <LM_ID>
LMPR04000022

> <COMMON_NAME>
32,35-anhydrobacteriohopaneterol

> <SYSTEMATIC_NAME>


> <FORMULA>
C35H60O3

> <MASS>
528.45

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Hopanoids [PR04]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
AHIYJXIRRHDLAB-PAJINBBCSA-N

> <INCHI>
InChI=1S/C35H60O3/c1-22(9-10-26-30(37)25(36)21-38-26)23-13-18-32(4)24(23)14-19-34(6)28(32)11-12-29-33(5)17-8-16-31(2,3)27(33)15-20-35(29,34)7/h22-30,36-37H,8-21H2,1-7H3/t22-,23?,24?,25-,26?,27?,28?,29?,30-,32-,33-,34+,35+/m0/s1

> <SMILES>
C1C[C@]2(C)C3CCC4[C@]5(C)C(C([C@H](CCC6[C@@H](O)[C@@H](O)CO6)C)CC5)CC[C@@]4(C)[C@]3(C)CCC2C(C)(C)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
183133

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608329

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2

> <CITATION>
17294511

$$$$