LMSP01080094
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0  0  0  0  0  0  0  0999 V2000
   19.2204   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3340   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4472   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5604   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6736   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7868   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9000   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0133   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1265   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2397   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3528   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4660   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5793   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6924   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8057   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9189   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0321   -7.1696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1453   -6.6616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3340   -8.1856    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.4472   -5.6455    0.0000 O   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  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
  2 19  1  6  0  0  0
  3 20  1  1  0  0  0
M  END
> <LM_ID>
LMSP01080094

> <COMMON_NAME>
Crucigasterin 275

> <SYSTEMATIC_NAME>
1-deoxy-sphinga-5E,9Z,12Z,15Z,17-pentaenine

> <FORMULA>
C18H29NO

> <MASS>
275.22

> <CATEGORY>
Sphingolipids [SP]

> <MAIN_CLASS>
Sphingoid bases [SP01]

> <SUB_CLASS>
Sphingoid base analogs [SP0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
DBUTWWBBBQFAJO-LFPPQAFFSA-N

> <INCHI>
InChI=1S/C18H29NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)17(2)19/h3-5,7-8,10-11,14-15,17-18,20H,1,6,9,12-13,16,19H2,2H3/b5-4-,8-7-,11-10-,15-14+/t17-,18+/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
282281

> <CITATION>
-

$$$$