LMST02030316
  LIPID_MAPS_STRUCTURE_DATABASE

 28 32  0     0  0            999 V2000
    3.9855   -7.0387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8515   -7.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8515   -8.5388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9855   -9.0388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1195   -8.5388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1195   -7.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7175   -7.0387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5836   -7.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5836   -8.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7175   -9.0387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7175   -6.0387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5835   -5.5386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4496   -6.0386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4496   -7.0386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8515   -6.5387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5836   -6.5387    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4007   -5.7295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9885   -6.5385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4007   -7.3476    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8616   -5.2296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4005   -4.7294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2095   -4.1415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8515   -9.5388    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4496   -8.0386    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3666   -5.4707    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7175   -8.0387    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4493   -4.4204    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2534   -9.0387    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  1  1  0     0  0
  2  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10  3  1  0     0  0
  7 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14  8  1  0     0  0
  2 15  1  1     0  0
  8 16  1  1     0  0
 13 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 14  1  0     0  0
 13 20  1  1     0  0
 21 17  1  0     0  0
 21 22  1  1     0  0
  3 23  1  6     0  0
 14 24  1  6     0  0
 17 25  1  6     0  0
  7 26  1  6     0  0
 20 27  2  0     0  0
 27 21  1  0     0  0
  5 28  1  1     0  0
M  END
> <LM_ID>
LMST02030316

> <COMMON_NAME>
Wrightiamine A

> <SYSTEMATIC_NAME>


> <FORMULA>
C21H34N2

> <MASS>
314.27

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Steroids [ST02]

> <SUB_CLASS>
C21 steroids (gluco/mineralocorticoids, progestogins) and derivatives [ST0203]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OWJXANQNZAVDIW-XLVUHOLYSA-N

> <INCHI>
InChI=1S/C21H34N2/c1-13-17-5-6-19-16-4-3-14-11-15(22)7-9-20(14,2)18(16)8-10-21(17,19)12-23-13/h12-19H,3-11,22H2,1-2H3/t13-,14-,15-,16+,17+,18-,19-,20-,21-/m0/s1

> <SMILES>
C1C[C@H](N)C[C@]2([H])CC[C@@]3([H])[C@]4([H])CC[C@]5([H])[C@@H](N=C[C@]45CC[C@]3([H])[C@@]12C)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
66330

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11109831

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
69390

> <CITATION>
12808258

$$$$