LMFA06000160
  LIPID_MAPS_STRUCTURE_DATABASE

 17 16  0     0  0            999 V2000
   16.3004    6.8940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2240    6.3606    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.3004    7.7482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3699    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4390    6.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5079    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5770    6.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6461    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7152    6.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7843    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8534    6.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9224    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9915    6.8939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    6.3606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4390    7.6532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7152    7.6532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9915    7.6532    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
  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  2  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  2  0  0  0  0
 13 14  1  0  0  0  0
  5 15  1  6  0  0  0
  9 16  1  0  0  0  0
 13 17  1  0  0  0  0
M  END
> <LM_ID>
LMFA06000160

> <COMMON_NAME>
S-2,3-dihydrofarnesal

> <SYSTEMATIC_NAME>
3S,7,11-Trimethyl-6E,10-dodecadienal

> <FORMULA>
C15H26O

> <MASS>
222.20

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C15 isoprenoids (sesquiterpenes) [PR0103]

> <CLASS_LEVEL4>
Acyclic farnesane sesquiterpenoids [PR010301]

> <SYNONYMS>


> <INCHI_KEY>
ITBYWGRSPHMAEE-HNRFISLBSA-N

> <INCHI>
InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,12,15H,5-6,8,10-11H2,1-4H3/b14-9+/t15-/m0/s1

> <SMILES>
C(C[C@@H](C)CC/C=C(\C)/CC/C=C(\C)/C)(=O)[H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FAL 15:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44256573

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Prenol Lipids [PR]

> <ALT_MAIN_CLASSES>
Isoprenoids [PR01]

> <ALT_SUB_CLASSES>
C15 isoprenoids (sesquiterpenes) [PR0103]

> <ALT_CLASS_LEVEL4S>
Acyclic farnesane sesquiterpenoids [PR010301]

> <TAXONOMY>
28641

> <CITATION>
-

$$$$