LMFA08020090
  LIPID_MAPS_STRUCTURE_DATABASE

 30 29  0  0  0  0  0  0  0  0999 V2000
   18.8363    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2496    5.8217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8416    6.5555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3278    7.2576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8104    7.9367    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   19.2418    8.6569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8054    9.1184    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.8444    8.6620    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9249    5.8135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0773    7.5396    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.3264    8.4337    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.3693    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3693    8.7320    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6413    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9137    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1861    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4585    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7310    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0034    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2758    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5482    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8206    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0931    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3655    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6379    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9104    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1827    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4551    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7276    8.0201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  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
  6  8  2  0  0  0  0
  2  9  2  0  0  0  0
  5 10  1  6  0  0  0
  5 11  1  1  0  0  0
 10 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 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  1  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
 29 30  1  0  0  0  0
M  END
> <LM_ID>
LMFA08020090

> <COMMON_NAME>
N-stearoyl glutamic acid

> <SYSTEMATIC_NAME>
N-octadecanoyl-glutamic acid

> <FORMULA>
C23H43NO5

> <MASS>
413.31

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty amides [FA08]

> <SUB_CLASS>
N-acyl amino acids [FA0805]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ATFFFUXLAJBBDE-FQEVSTJZSA-N

> <INCHI>
InChI=1S/C23H43NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(25)24-20(23(28)29)18-19-22(26)27/h20H,2-19H2,1H3,(H,24,25)(H,26,27)(H,28,29)/t20-/m0/s1

> <SMILES>
OC(=O)CC[C@]([H])(NC(CCCCCCCCCCCCCCCCC)=O)C(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
165566

> <ABBREVIATION>
NAGlu 18:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
94481

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
10116

> <CITATION>
19584404

$$$$