LMPR0102090029
  LIPID_MAPS_STRUCTURE_DATABASE

 11 11  0  0  0  0  0  0  0  0999 V2000
    5.7170    6.2351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4306    6.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.6502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7205    5.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4306    7.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1408    6.2384    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0034    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4341    5.0035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7170    7.8853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7205    8.7120    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  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  0  0  0  0
  7 10  2  0  0  0  0
M  END
> <LM_ID>
LMPR0102090029

> <COMMON_NAME>
Thymol

> <SYSTEMATIC_NAME>


> <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>


> <INCHI_KEY>
MGSRCZKZVOBKFT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3

> <SMILES>
C1(C(C)C)=CC=C(C)C=C1O

> <KEGG_ID>
C09908

> <HMDB_ID>
HMDB0001878

> <CHEBI_ID>
27607

> <ABBREVIATION>
-

> <CAYMAN_ID>
34496

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6989

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$