LMFA01170075
  LIPID_MAPS_STRUCTURE_DATABASE

 24 23  0  0  0  0  0  0  0  0999 V2000
    6.6167    6.8846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3284    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0402    6.8846    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    8.7521    6.4576    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.4638    6.8846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1756    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8874    6.8846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5992    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3110    6.8846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0227    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7346    6.8846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4464    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1581    6.8846    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8699    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9049    6.4576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1930    6.8846    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9049    5.6390    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0402    7.7032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7521    8.0947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3284    8.0947    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7521    5.6390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0402    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4638    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0402    6.0661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
 15  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
 18  3  1  0  0  0  0
  3 24  1  6  0  0  0
  4  5  1  6  0  0  0
 21  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 16 15  2  0  0  0  0
 17 15  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 22 21  2  0  0  0  0
 23 21  1  0  0  0  0
M  END
> <LM_ID>
LMFA01170075

> <COMMON_NAME>
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid

> <SYSTEMATIC_NAME>
(3S,4S)-3-hydroxytetradecane-1,3,4-tricarboxylic acid

> <FORMULA>
C17H30O7

> <MASS>
346.20

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(3S,4S)-3-Hydroxytetradecane-1,3,4-tricarboxylate

> <INCHI_KEY>
QFOFNCNFUGQWTO-DYVFJYSZSA-N

> <INCHI>
InChI=1S/C17H30O7/c1-2-3-4-5-6-7-8-9-10-13(15(20)21)17(24,16(22)23)12-11-14(18)19/h13,24H,2-12H2,1H3,(H,18,19)(H,20,21)(H,22,23)/t13-,17+/m1/s1

> <SMILES>
C(C(O)=O)C[C@@](O)(C(O)=O)[C@@H](C(O)=O)CCCCCCCCCC

> <KEGG_ID>
C04529

> <HMDB_ID>
-

> <CHEBI_ID>
15615

> <ABBREVIATION>
FA 17:2;O5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5460247

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$