LMFA08020356
  LIPID_MAPS_STRUCTURE_DATABASE

 26 25  0     0  0            999 V2000
    2.5699    0.4294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4299    0.9260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4299    1.9190    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2899    0.4294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1499    0.9260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0099    0.4294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8702    0.9260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7302    0.4294    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2899   -0.5637    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4215   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4215   -2.0678    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5530   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6845   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8162   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0522   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9207   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7891   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6845   -2.0678    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6576   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5260   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3945   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2629   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1313   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9999   -1.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8684   -0.5637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9999   -2.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  2  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  1  0     0  0
  7  8  1  0     0  0
  4  9  1  0     0  0
  9 10  1  0     0  0
 10 11  2  0     0  0
 10 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 13 18  1  0     0  0
 17 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 24 26  1  0     0  0
M  END
> <LM_ID>
LMFA08020356

> <COMMON_NAME>
alpha-N-(3-hydroxy-13-methyl-tetradecanoyl)-ornithine

> <SYSTEMATIC_NAME>
5-amino-2-(3-hydroxy-13-methyl-tetradecanamido)pentanoic acid

> <FORMULA>
C20H40N2O4

> <MASS>
372.30

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amines [FA0802]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
CEHRCHKUTZADMT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C20H40N2O4/c1-16(2)11-8-6-4-3-5-7-9-12-17(23)15-19(24)22-18(20(25)26)13-10-14-21/h16-18,23H,3-15,21H2,1-2H3,(H,22,24)(H,25,26)

> <SMILES>
OC(C(NC(CC(O)CCCCCCCCCC(C)C)=O)CCCN)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
170989342

> <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>
Hydroxy fatty acids [FA0105]; Amino fatty acids [FA0110]; Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
1937692

> <CITATION>
34500726

$$$$