LMPR0102010003
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0  0  0  0  0999 V2000
    8.5729    5.4134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8560    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2859    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5729    6.2365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1430    5.4134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9990    5.4134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4299    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7158    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7131    5.4134    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7131    6.2365    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  2  0  0  0  0
  7  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
M  END
> <LM_ID>
LMPR0102010003

> <COMMON_NAME>
Geranial

> <SYSTEMATIC_NAME>
Geranial

> <FORMULA>
C10H16O

> <MASS>
152.12

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C10 isoprenoids (monoterpenes) [PR0102]

> <CLASS_LEVEL4>
Acyclic monoterpenoids [PR010201]

> <SYNONYMS>


> <INCHI_KEY>
WTEVQBCEXWBHNA-JXMROGBWSA-N

> <INCHI>
InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+

> <SMILES>
C(/C)(=C/C=O)\CC/C=C(\C)/C

> <KEGG_ID>
C01499

> <HMDB_ID>
HMDB0035078

> <CHEBI_ID>
16980

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
638011

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$