LMPR01040143
  LIPID_MAPS_STRUCTURE_DATABASE

 28 30  0     0  0            999 V2000
   10.3753    8.9468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3753    7.9456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0832    7.2378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0832    9.6546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0501    6.9787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0501    9.9135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9171    9.4131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9171    7.4792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2810    8.3873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5826    6.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8854    7.6182    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8839    9.6721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4175   10.2800    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5085    9.4472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6416    8.9468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6416    7.9456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5085    7.4451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1161    6.9787    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1161    9.9135    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3003   10.4262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3047   10.5309    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8976    9.6165    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8042   11.3979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9200   12.6903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9780   12.3838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1519   13.3697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2112   13.0273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2581    6.4936    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
  4  1  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9  8  1  0  0  0  0
  3 10  2  0  0  0  0
  8 11  1  6  0  0  0
  9 11  1  6  0  0  0
  7 12  1  1  0  0  0
  7 13  1  6  0  0  0
  1 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 17  2  1  0  0  0  0
  2 18  1  1  0  0  0
  1 19  1  6  0  0  0
 14 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 15  1  0  0  0  0
 21 23  2  0  0  0  0
 24 25  1  0  0  0  0
 25 23  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
 17 28  1  0     0  0
M  END
> <LM_ID>
LMPR01040143

> <COMMON_NAME>
Novaxenicin D

> <SYSTEMATIC_NAME>


> <FORMULA>
C20H28O6

> <MASS>
364.19

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QYSAEOBDCOBHDU-GVMFGWQHSA-N

> <INCHI>
InChI=1S/C20H28O6/c1-11-7-16-17(26-16)20(4,24)6-5-13(15(11)10-21)14-8-12(25-18(14)22)9-19(2,3)23/h8-9,13,15-17,21,23-24H,1,5-7,10H2,2-4H3/b12-9+/t13-,15+,16-,17-,20+/m1/s1

> <SMILES>
[C@@]1([H])(C2=C/C(=C\C(C)(O)C)/OC2=O)CC[C@@](O)(C)[C@@H]2O[C@@H]2CC(=C)[C@]1([H])CO

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21778843

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
86539

> <CITATION>
18033582

$$$$