LMFA13040097
  LIPID_MAPS_STRUCTURE_DATABASE

 21 21  0     0  0            999 V2000
    9.2210   -6.1154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8476   -6.1155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5315   -4.1652    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3790   -4.6526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3790   -5.6277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5315   -6.1155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6897   -5.6279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6897   -4.6528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8476   -4.1653    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1116   -4.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9569   -4.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8021   -4.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6472   -4.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4924   -4.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3375   -4.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1915   -4.1871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4370   -4.1574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3375   -5.6661    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2577   -4.6851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4038   -4.1920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3934   -4.7219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  8  3  1  0     0  0
  3  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
  8  9  1  6     0  0
  5  1  1  6     0  0
  7  2  1  1     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
  4 17  1  1     0  0
 15 18  2  0     0  0
 10 19  1  0     0  0
 19 20  1  0     0  0
 17 21  1  0     0  0
 20 21  1  0     0  0
M  END
> <LM_ID>
LMFA13040097

> <COMMON_NAME>
oscr#3

> <SYSTEMATIC_NAME>
9-(3,6-dideoxy-alpha-L-arabino-hexopyranosyloxy)-2E-nonenoic acid

> <FORMULA>
C15H26O6

> <MASS>
302.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty acyl glycosides [FA13]

> <SUB_CLASS>
Ascarosides [FA1304]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
9-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-2E-nonenoic acid

> <INCHI_KEY>
CYRZSEWKKCHVSI-XHDDSBKUSA-N

> <INCHI>
InChI=1S/C15H26O6/c1-11-12(16)10-13(17)15(21-11)20-9-7-5-3-2-4-6-8-14(18)19/h6,8,11-13,15-17H,2-5,7,9-10H2,1H3,(H,18,19)/b8-6+/t11-,12+,13+,15+/m0/s1

> <SMILES>
O[C@@H]1C[C@@H](O)[C@H](C)O[C@H]1OCCCCCC/C=C/C(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
79131

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
86289769

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
6239

> <CITATION>
22239548

$$$$