LMPR0102090056
  LIPID_MAPS_STRUCTURE_DATABASE

 11 11  0     0  0            999 V2000
    6.9266    9.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    9.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7927    9.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7927    8.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9266    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    8.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9266   10.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9266    6.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7927    6.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6586    7.5605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  1  1  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  3  4  1  0  0  0  0
 11  4  2  0  0  0  0
  4  5  1  0  0  0  0
  8  5  2  0  0  0  0
  6  5  1  0  0  0  0
  2  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  1  0  0  0  0
M  END
> <LM_ID>
LMPR0102090056

> <COMMON_NAME>
piperitenone

> <SYSTEMATIC_NAME>
p-mentha-1,4(8)-dien-3-one

> <FORMULA>
C10H14O

> <MASS>
150.10

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

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

> <CLASS_LEVEL4>
Menthane monoterpenoids [PR010209]

> <SYNONYMS>
Piperitenone; piperitenone

> <INCHI_KEY>
HKZQJZIFODOLFR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h6H,4-5H2,1-3H3

> <SMILES>
C1(=CC(/C(/CC1)=C(\C)/C)=O)C

> <KEGG_ID>
C01951

> <HMDB_ID>
HMDB0036999

> <CHEBI_ID>
17304

> <ABBREVIATION>
-

> <CAYMAN_ID>
25752

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
381152

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
3483

> <CITATION>
4414686

$$$$