LMPR0104310002
  LIPID_MAPS_STRUCTURE_DATABASE

 26 29  0     0  0            999 V2000
    9.3492    9.6204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6062    8.9102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6062    7.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4746    7.4062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3431    7.9075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6526    9.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0633    8.4089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6526    7.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.4089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1269    7.2823    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1045    7.5055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5396    8.4089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1045    9.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3358    9.7860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3137    9.7939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1043    9.2372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8134    9.9463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0729    8.9779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3931    6.6291    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8479   10.4888    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3431    8.9102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3137   10.7965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8674    6.3138    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7296    6.7216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6129   10.7497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4746    8.4089    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  2  0  0  0  0
  2  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  3  1  0  0  0  0
  7  9  1  1  0  0  0
  5 10  1  0  0  0  0
 10 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
  1 15  1  0  0  0  0
 15 14  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
  8 19  1  1  0  0  0
  1 20  2  0  0  0  0
  5 21  1  0  0  0  0
 15 22  1  6  0  0  0
 10 23  1  6  0  0  0
 11 24  1  1  0  0  0
 14 25  1  6  0  0  0
  3 26  1  1  0  0  0
  2 26  1  1  0  0  0
 12 16  1  1  0  0  0
 13 16  1  1  0  0  0
M  END
> <LM_ID>
LMPR0104310002

> <COMMON_NAME>
Ingol

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H30O6

> <MASS>
366.20

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C20 isoprenoids (diterpenes) [PR0104]

> <CLASS_LEVEL4>
Lathyrane diterpenoids [PR010431]

> <SYNONYMS>


> <INCHI_KEY>
MXSMLDVUIRKKID-DWTONDLBSA-N

> <INCHI>
InChI=1S/C20H30O6/c1-8-6-19-16(24)9(2)7-20(19,26-19)17(25)10(3)14(22)11-12(18(11,4)5)15(23)13(8)21/h6,9-16,21-24H,7H2,1-5H3/b8-6+/t9-,10+,11-,12+,13+,14-,15+,16-,19-,20-/m0/s1

> <SMILES>
C1(=O)[C@H](C)[C@H](O)[C@H]2C([C@H]2[C@@H](O)[C@H](O)C(C)=C[C@@]23O[C@@]12C[C@H](C)[C@@H]3O)(C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
42608245

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
216478

> <CITATION>
-

$$$$