LMFA11000042
  LIPID_MAPS_STRUCTURE_DATABASE

 10  9  0     0  0            999 V2000
   12.5561    7.3494    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6286    6.8176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7006    7.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7725    6.8176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8445    7.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167    6.8176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9886    7.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.8176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6286    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9167    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  2  9  1  0  0  0  0
  6 10  1  0  0  0  0
M  END
> <LM_ID>
LMFA11000042

> <COMMON_NAME>
Alloocimene

> <SYSTEMATIC_NAME>
2,6-Dimethyl-2,4E,6E-octatriene

> <FORMULA>
C10H16

> <MASS>
136.13

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Hydrocarbons [FA11]

> <SUB_CLASS>


> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GQVMHMFBVWSSPF-SOYUKNQTSA-N

> <INCHI>
InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-4H3/b8-6+,10-5+

> <SMILES>
C/C(/C)=C/C=C/C(/C)=C/C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
141222

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5368821

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630; 105371

> <CITATION>
24264320

$$$$