LMFA01031338
  LIPID_MAPS_STRUCTURE_DATABASE

 29 28  0     0  0            999 V2000
   -0.4348   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4348   -0.7531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4348    0.7531    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3108   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1872   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0636   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9400   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8163   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6927   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5690   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4454   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3218   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1982   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0746   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9510   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8274   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7037   -0.2511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5801   -0.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5801   -1.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7037   -2.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8274   -1.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9510   -2.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0746   -1.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1982   -1.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3218   -2.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4454   -1.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5690   -2.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6927   -1.6295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8163   -2.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  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  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
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
M  END
> <LM_ID>
LMFA01031338

> <COMMON_NAME>
Cudlmanic acid

> <SYSTEMATIC_NAME>
21Z-heptacosenoic acid

> <FORMULA>
C27H52O2

> <MASS>
408.40

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
C27:1n-6

> <INCHI_KEY>
TYRPZDWTUKSACD-SREVYHEPSA-N

> <INCHI>
InChI=1S/C27H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28)29/h6-7H,2-5,8-26H2,1H3,(H,28,29)/b7-6-

> <SMILES>
C(CCCCCCCCCCCCCCCCCCC/C=C\CCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 27:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171117698

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
9606

> <CITATION>
37402773

$$$$