LMPR0104230002
  LIPID_MAPS_STRUCTURE_DATABASE

 35 38  0     0  0            999 V2000
    8.6571   10.7171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6571    9.7177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5226    9.2179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5226   11.2168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0105    8.6640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0477    8.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9442    9.0178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4887    9.8552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4487   10.8537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8352   11.6435    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8724   11.9117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9402   11.5506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3882   10.7171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3882    9.7177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5226    8.2185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4405   12.4161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3882   11.7164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3882    8.7183    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0584    7.6668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0217    7.4041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5692    8.2391    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3758    6.4696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2790    7.0412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3875   11.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6571   11.7164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7916    9.2179    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9260    9.7177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    9.2179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9260   10.7171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5481    8.0666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5481    7.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6825    6.5675    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2548    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7518    9.6294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4540    9.5965    0.0000 Cl  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 14  1  0  0  0  0
 13  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  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
  6 14  1  0  0  0  0
  3 15  1  1  0  0  0
 12 16  1  1  0  0  0
 13 17  1  1  0  0  0
 14 18  1  6  0  0  0
  5 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
  7 21  1  6  0  0  0
 20 22  2  0  0  0  0
 19 23  1  6  0  0  0
  9 24  2  0  0  0  0
  4 25  1  6  0  0  0
  1 25  1  6  0  0  0
  2 26  1  6  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
  6 30  1  1  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
  5 34  1  6  0  0  0
  8 35  1  6  0  0  0
M  END
> <LM_ID>
LMPR0104230002

> <COMMON_NAME>
Brianthein X

> <SYSTEMATIC_NAME>
9beta,12alpha-diacetoxy-6alpha-chloro-13alpha,14alpha-epoxy-2-hydroxy-3,5(16)-briaradiene-18,7-olide

> <FORMULA>
C24H31O9Cl

> <MASS>
498.17

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Briarane diterpenoids [PR010423]

> <SYNONYMS>


> <KEGG_ID>
-

> <HMDB_ID>
-

> <YMDB_ID>
-

> <CHEBI_ID>
-

> <CAYMAN_ID>
-

> <PLANTFA_ID>
-

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
21669868

> <LIPIDBANK_ID>
-

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMPR0104230002

$$$$