LMPR0103700006
  LIPID_MAPS_STRUCTURE_DATABASE

 16 18  0  0  0  0  0  0  0  0999 V2000
    6.8821    7.3480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2043    6.9567    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.2043    6.1740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8821    5.7826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5598    6.1740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5598    6.9567    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.4600    7.1985    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.0000    6.5654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4600    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2903    7.9236    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4760    7.9069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3158    5.9714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7625    5.4181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2575    7.9545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8821    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2575    5.1763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  1  0  0  0
  7  2  1  0  0  0  0
  3  2  1  0  0  0  0
  9  3  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
 10  2  1  0  0  0  0
  6 11  1  0  0  0  0
 10 11  1  0  0  0  0
  5 12  1  0  0  0  0
  5 13  1  0  0  0  0
  7 14  1  6  0  0  0
  4 15  1  0  0  0  0
  9 16  2  0  0  0  0
M  END
> <LM_ID>
LMPR0103700006

> <COMMON_NAME>
albaflavenone

> <SYSTEMATIC_NAME>
(3S,3aR,6S)-3,7,7,8-tetramethyl-2,3,4,5,6,7-hexahydro-1H-3a,6-methanoazulen-1-one

> <FORMULA>
C15H22O

> <MASS>
218.17

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Zizaane and prezizaane sesquiterpenoids [PR010370]

> <SYNONYMS>
(+)-epi-isozizaen-5-one;(1R,2S,8S)-2,6,7,7-tetramethyltricyclo[6.2.1.0(1,5)]undec-5-en-4-one; albaflavenone

> <INCHI_KEY>
SHUZZAXJEJPUGA-YSTXANQKSA-N

> <INCHI>
InChI=1S/C15H22O/c1-9-7-12(16)13-10(2)14(3,4)11-5-6-15(9,13)8-11/h9,11H,5-8H2,1-4H3/t9-,11?,15+/m0/s1

> <SMILES>
C1[C@@H]2CC[C@]31C(C(=O)C[C@@H]3C)=C(C)C2(C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
25137938

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$