LMFA07011015
  LIPID_MAPS_STRUCTURE_DATABASE

 20 20  0  0  0  0            999 V2000
   -2.8542    2.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8542    1.6525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5702    1.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1424    1.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4265    1.6525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7147    1.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0013    1.6525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7131    1.2403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0013    2.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4291    1.6525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1424    1.2403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1424    0.4157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570    0.0034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570   -0.8211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4291    0.0034    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1424   -1.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1424   -2.0648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570   -2.4771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5702   -2.0648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5702   -1.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  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
  7  9  1  0  0  0  0
  8 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
 12 15  2  0  0  0  0
 13 14  1  0  0  0  0
 14 16  2  0  0  0  0
 14 20  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
M  END
> <LM_ID>
LMFA07011015

> <COMMON_NAME>
Rhodinyl phenylacetate

> <SYSTEMATIC_NAME>
3,7-dimethyloct-7-en-1-yl 2-phenylacetate

> <FORMULA>
C18H26O2

> <MASS>
274.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SKZDJVXLRPCFQC-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C18H26O2/c1-15(2)8-7-9-16(3)12-13-20-18(19)14-17-10-5-4-6-11-17/h4-6,10-11,16H,1,7-9,12-14H2,2-3H3

> <SMILES>
CC(CCCC(C)CCOC(=O)CC1C=CC=CC=1)=C

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0037191

> <CHEBI_ID>
-

> <ABBREVIATION>
SFE 18:5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
61521

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Branched fatty acids [FA0102]; Carbocyclic fatty acids [FA0114]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$