LMPR0103090030
  LIPID_MAPS_STRUCTURE_DATABASE

 20 22  0     0  0            999 V2000
   11.1924   -5.5293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1250   -5.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0727   -6.8851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1077   -7.1436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5637   -6.3058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9080   -5.5791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2876   -6.5022    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8074   -7.3776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8268   -7.5501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9389   -5.3036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5694   -7.7878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3338   -4.4427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4604   -4.3241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9443   -3.4502    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6902   -7.8855    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2370   -6.8107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2370   -7.8091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2876   -8.1176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0540   -8.4027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9502   -9.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  1  1  0     0  0
 10  2  2  0     0  0
  6 10  1  0     0  0
  9  3  2  0     0  0
  8  9  1  0     0  0
  7  8  1  0     0  0
  6  7  1  0     0  0
  4 11  1  0     0  0
 12 13  1  0     0  0
 13 10  1  0     0  0
  1 12  1  1     0  0
 13 14  2  0     0  0
  4 15  1  6     0  0
  7 16  1  6     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
  8 18  1  1     0  0
 17 19  2  0     0  0
 18 20  2  0     0  0
M  END
> <LM_ID>
LMPR0103090030

> <COMMON_NAME>
Elephantopinolide M

> <SYSTEMATIC_NAME>


> <FORMULA>
C15H16O5

> <MASS>
276.10

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C15 isoprenoids (sesquiterpenes) [PR0103]

> <CLASS_LEVEL4>
Germacrane sesquiterpenoids [PR010309]

> <SYNONYMS>


> <INCHI_KEY>
DIOKUCNWNFHLAB-NRGWLUSISA-N

> <INCHI>
InChI=1S/C15H16O5/c1-8-11-3-4-15(2,18)7-10-5-9(14(17)19-10)6-12(11)20-13(8)16/h3-5,10-12,18H,1,6-7H2,2H3/b4-3+/t10-,11+,12-,15-/m0/s1

> <SMILES>
[C@@H]12OC(=O)C(C[C@@H]3OC(=O)C(=C)[C@H]3C=C[C@@](O)(C)C1)=C2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
162663272

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
396369

> <CITATION>
32371334

$$$$