LMFA13040149
  LIPID_MAPS_STRUCTURE_DATABASE

 26 27  0     0  0            999 V2000
    9.4539   -4.2704    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4539   -6.2699    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9955   -6.2700    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7217   -4.2704    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5908   -4.7702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5908   -5.7699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7217   -6.2700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8586   -5.7701    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8586   -4.7704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9955   -4.2705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6415   -2.7736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5079   -3.2739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3745   -2.7736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2409   -3.2739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1075   -2.7736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9738   -3.2740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4966   -7.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4966   -7.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9977   -8.0020    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9966   -8.0040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9966   -8.0040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4966   -7.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9966   -6.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9966   -6.2719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4966   -7.1379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1076   -1.7736    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  9  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  0     0  0
  9 10  1  6     0  0
  5  1  1  1     0  0
  6  2  1  6     0  0
  8  3  1  1     0  0
 11 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
 12  1  1  6     0  0
  3 17  1  0     0  0
 17 18  1  0     0  0
 17 19  2  0     0  0
 18 20  1  0     0  0
 20 21  2  0     0  0
 21 22  1  0     0  0
 22 23  2  0     0  0
 23 24  1  0     0  0
 24 18  2  0     0  0
 22 25  1  0     0  0
 15 26  2  0     0  0
M  END
> <LM_ID>
LMFA13040149

> <COMMON_NAME>
hbas#9

> <SYSTEMATIC_NAME>
4R-(3,6-dideoxy-(4-O-hydroxybenzoyl)alpha-L-arabino-hexopyranosyloxy)-pentanoic acid

> <FORMULA>
C18H24O8

> <MASS>
368.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty acyl glycosides [FA13]

> <SUB_CLASS>
Ascarosides [FA1304]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4R-(3'R-hydroxy-5'R-O-(4-hydroxybenzoyl)-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-pentanoic acid

> <INCHI_KEY>
GOULJBFAJHFZIY-WJOFSXDMSA-N

> <INCHI>
InChI=1S/C18H24O8/c1-10(3-8-16(21)22)24-18-14(20)9-15(11(2)25-18)26-17(23)12-4-6-13(19)7-5-12/h4-7,10-11,14-15,18-20H,3,8-9H2,1-2H3,(H,21,22)/t10-,11+,14-,15-,18-/m1/s1

> <SMILES>
O([C@@H](CCC(=O)O)C)[C@H]1[C@H](O)C[C@@H](OC(=O)C2=CC=C(O)C=C2)[C@H](C)O1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
171120328

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
6239

> <CITATION>
22239548

$$$$