LMSP01080076
  LIPID_MAPS_STRUCTURE_DATABASE

 18 17  0     0  0            999 V2000
   21.0421    7.8207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1580    7.3139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2733    7.8207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3886    7.3139    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5039    7.8207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1509    7.7956    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2664    7.2889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1580    6.3004    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.2733    8.8344    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.6478    7.3225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4103    7.7870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5508    7.2946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6946    7.7927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7821    7.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9199    7.3165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0762    7.8063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8269    7.2955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9625    7.7984    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
  6  7  1  0  0  0  0
  2  8  1  6  0  0  0
  3  9  1  1  0  0  0
  5 10  1  0     0  0
  7 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 10 14  1  0     0  0
 14 15  1  0     0  0
 16  6  2  0  0  0  0
 15 16  1  0     0  0
 13 17  1  0     0  0
 17 18  1  0     0  0
M  END
> <LM_ID>
LMSP01080076

> <COMMON_NAME>
Obscuraminol D

> <SYSTEMATIC_NAME>
1-deoxy-9Z-hexadecasphingenine

> <FORMULA>
C16H33NO

> <MASS>
255.26

> <CATEGORY>
Sphingolipids [SP]

> <MAIN_CLASS>
Sphingoid bases [SP01]

> <SUB_CLASS>
Sphingoid base analogs [SP0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
SHEYJRIILVVUIW-LWULTOEVSA-N

> <INCHI>
InChI=1S/C16H33NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-16(18)15(2)17/h8-9,15-16,18H,3-7,10-14,17H2,1-2H3/b9-8-/t15-,16+/m0/s1

> <SMILES>
C[C@H](N)[C@H](O)CCCCC/C=C\CCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
101101127

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
282280

> <CITATION>
-

$$$$