LMSP01080053
  LIPID_MAPS_STRUCTURE_DATABASE

 23 24  0  0  0  0  0  0  0  0999 V2000
   12.8566   11.0223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8566    9.9762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7624    9.4532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6684    9.9762    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6684   11.0223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7624   11.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5742    9.4532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4801    9.9762    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4801   11.0223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5742   11.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5742    8.5975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4272    9.4294    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1531    8.3393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2380    8.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6087    7.8447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6938    8.0431    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0643    7.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1494    7.5485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5200    6.8553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6050    7.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9756    6.3607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0607    6.5592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6684   11.8709    0.0000 H   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  1  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  1  6  0  0  0
  8 12  1  1  0  0  0
  3 13  1  6  0  0  0
 13 14  2  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  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
  5 23  1  6  0  0  0
M  END
> <LM_ID>
LMSP01080053

> <COMMON_NAME>
Clavepictine B

> <SYSTEMATIC_NAME>
(9aS)-6S-(deca-1,3E-dienyl)-4S-methyloctahydro-1H-quinolizin-3R-ol

> <FORMULA>
C20H35NO

> <MASS>
305.27

> <CATEGORY>
Sphingolipids [SP]

> <MAIN_CLASS>
Sphingoid bases [SP01]

> <SUB_CLASS>
Sphingoid base analogs [SP0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BWYKUGCLFVUKMC-PFAWIIGSSA-N

> <INCHI>
InChI=1S/C20H35NO/c1-3-4-5-6-7-8-9-10-12-18-13-11-14-19-15-16-20(22)17(2)21(18)19/h8-10,12,17-20,22H,3-7,11,13-16H2,1-2H3/b9-8+,12-10+/t17-,18+,19-,20+/m0/s1

> <SMILES>
C1C[C@@]2([H])CC[C@@H](O)[C@H](C)N2[C@H](/C=C/C=C/CCCCCC)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
137833

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10425214

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
201959

> <CITATION>
-

$$$$