LMFA07040177
  LIPID_MAPS_STRUCTURE_DATABASE

 16 16  0     0  0            999 V2000
   -0.3229    0.9992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5467    0.5012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4162    0.9992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2856    0.5012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1552    0.9992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0247    0.5012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8941    0.9992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7637    0.5012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5989   -0.3189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4504   -0.3189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1710    0.5169    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1885   -0.4840    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1459   -0.7768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7201    0.0432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1176    0.8428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4718   -1.7233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  6  9  1  0     0  0
  6 10  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 11  1  0     0  0
 13 16  2  0     0  0
 11  1  1  0  0  0  0
M  END
> <LM_ID>
LMFA07040177

> <COMMON_NAME>
YT02-A

> <SYSTEMATIC_NAME>
4,10-dihydroxy-10-methyldodecan-4-olide

> <FORMULA>
C13H24O3

> <MASS>
228.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
RUBODPIDZMQESI-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C13H24O3/c1-3-13(2,15)10-6-4-5-7-11-8-9-12(14)16-11/h11,15H,3-10H2,1-2H3

> <SMILES>
C(C1CCC(=O)O1)CCCCC(C)(O)CC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
189346

> <ABBREVIATION>
FA 13:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
25198820

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1928

> <CITATION>
35123882

$$$$