LMFA01030296
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   21.0811    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9578    6.3607    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.0811    7.6777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.1979    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3144    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4307    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5472    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6636    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7800    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8965    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0129    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1293    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2458    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3621    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4785    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5950    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7114    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8278    6.8670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9442    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.8670    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  2  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
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030296

> <COMMON_NAME>
5Z-octadecenoic acid

> <SYSTEMATIC_NAME>
5Z-octadecenoic acid

> <FORMULA>
C18H34O2

> <MASS>
282.26

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
C18:1n-13

> <INCHI_KEY>
AQWHMKSIVLSRNY-YPKPFQOOSA-N

> <INCHI>
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h13-14H,2-12,15-17H2,1H3,(H,19,20)/b14-13-

> <SMILES>
C(CCC/C=C\CCCCCCCCCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
196201

> <ABBREVIATION>
FA 18:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5312447

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Octadecanoids [FA02]

> <ALT_SUB_CLASSES>


> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
3457; 9606

> <CITATION>
33567271

$$$$