LMPR0104350002
  LIPID_MAPS_STRUCTURE_DATABASE

 25 27  0     0  0            999 V2000
    8.3333    9.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3333    8.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0403    7.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0404    7.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7475    8.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7475    9.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0404   10.2568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0403   10.2568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6986    8.2408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2863    9.0498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6986    9.8589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4423    8.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5986    7.1081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5864    6.9517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4094    9.9326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0403    6.0607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7475    7.5498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0075   10.8099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9858   11.0178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3386   11.5530    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7327    6.6081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5762    8.5959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4672    9.0498    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5404    8.7087    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4435    9.6737    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  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  1  2  0  0  0  0
  5  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11  6  2  0  0  0  0
  2 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  3  1  0  0  0  0
  1 15  1  0  0  0  0
 14 16  1  6  0  0  0
  5 17  1  6  0  0  0
 11 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 13 21  1  6  0  0  0
 12 22  2  0  0  0  0
  2 23  1  6  0  0  0
  3 24  1  1  0  0  0
 15 25  2  0  0  0  0
M  END
> <LM_ID>
LMPR0104350002

> <COMMON_NAME>
Periconicin A

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H28O3

> <MASS>
316.20

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Fusicoccane diterpenoids [PR010435]

> <SYNONYMS>


> <INCHI_KEY>
IUXNFOSJQWRNNO-ZFOLLOEKSA-N

> <INCHI>
InChI=1S/C20H28O3/c1-11(2)14-7-8-20(4)9-15-12(3)18(22)19(23)17(15)13(10-21)5-6-16(14)20/h5,10-12,15,17-18,22H,6-9H2,1-4H3/b13-5-/t12-,15+,17-,18-,20-/m0/s1

> <SMILES>
C1(C=O)=CCC2=C(C(C)C)CC[C@@]2(C)C[C@]2([H])[C@H](C)[C@H](O)C(=O)[C@@]12[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
185839

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10471036

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2654149

> <CITATION>
16193158

$$$$