LMFA05000640
  LIPID_MAPS_STRUCTURE_DATABASE

 23 22  0  0  0  0            999 V2000
   -0.7422   -0.5359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7422    0.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4021    0.7009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1447    0.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1447   -0.5359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8872   -0.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8872   -1.7734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1447   -2.1859    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4021   -1.8559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7422   -2.2684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0004   -1.8559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7422   -2.2684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4021   -1.7734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4021   -0.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7422   -0.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8246    0.3709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5671    0.7009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6496    1.5259    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4746    1.5259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4746    0.7009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2272   -0.6184    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2471    0.9484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8872    2.2684    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  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
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 21  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 22  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 19 23  1  0  0  0  0
M  END
> <LM_ID>
LMFA05000640

> <COMMON_NAME>
Avocadene 1-acetate

> <SYSTEMATIC_NAME>
2,4-dihydroxyheptadec-16-en-1-yl acetate

> <FORMULA>
C19H36O4

> <MASS>
328.26

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty alcohols [FA05]

> <SUB_CLASS>
-

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NLBYRERHXBTBBR-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H36O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h3,18-19,21-22H,1,4-16H2,2H3

> <SMILES>
C=CCCCCCCCCCCCC(O)CC(O)COC(C)=O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0031043

> <CHEBI_ID>
138785

> <ABBREVIATION>
FOH 19:2;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
3624980

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$