LMPR0104500001
  LIPID_MAPS_STRUCTURE_DATABASE

 23 24  0  0  0  0  0  0  0  0999 V2000
    5.0000    9.8454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    9.0204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7144    8.6079    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.4289    9.0204    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.4289    9.8454    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7144   10.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    8.6079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    9.0204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    9.8454    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434   10.2579    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.3019    7.8934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1269    7.8934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1269    7.0684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7103    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7103    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9959    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4248    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5724   10.2579    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289    8.1954    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5724   11.0829    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434   11.0829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579   11.4954    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289   10.6704    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
  3 11  1  1  0  0  0
  3 12  1  6  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
  9 18  1  0  0  0  0
  4 19  1  6  0  0  0
 18 20  2  0  0  0  0
 10 21  1  1  0  0  0
 21 22  2  0  0  0  0
  5 23  1  1  0  0  0
M  END
> <LM_ID>
LMPR0104500001

> <COMMON_NAME>
(-)-Sacculatal

> <SYSTEMATIC_NAME>
(-)-7,17-sacculatadiene-11,12-dial

> <FORMULA>
C20H30O2

> <MASS>
302.22

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Sacculatane diterpenoids [PR010450]

> <SYNONYMS>


> <INCHI_KEY>
CJRSLLMDIKKFIM-VNTMZGSJSA-N

> <INCHI>
InChI=1S/C20H30O2/c1-15(2)7-5-10-19(3)11-6-12-20(4)17(14-22)16(13-21)8-9-18(19)20/h7-8,13-14,17-18H,5-6,9-12H2,1-4H3/t17-,18-,19+,20+/m0/s1

> <SMILES>
C1C[C@]2(C)[C@@H](C=O)C(C=O)=CC[C@@]2([H])[C@@](CC/C=C(/C)\C)(C)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
14285716

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$