LMSP02010231
  LIPID_MAPS_STRUCTURE_DATABASE

 44 43  0  0  0  0  0  0  0  0999 V2000
   18.7050   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8356   -5.9962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9660   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2075   -7.3661    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.2025   -7.3661    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.5747   -5.9948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4442   -6.4968    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2917   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2917   -8.8855    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.3089   -5.1766    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3511   -5.1574    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.4156   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5394   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6630   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7868   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9105   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0342   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1579   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2816   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4053   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5290   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6527   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7765   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9002   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0240   -7.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1476   -7.3777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0893   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2132   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3369   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4606   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5843   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7081   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8318   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9554   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0791   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2029   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3266   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4503   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5740   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6977   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8215   -5.9963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9452   -6.4968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5843   -4.9894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4660   -6.6728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  1  5  1  6     0  0
  1  4  1  1     0  0
  6  1  1  0     0  0
  7  6  1  0     0  0
  8  9  2  0     0  0
  8  5  1  0     0  0
  2 10  1  1     0  0
  2 11  1  6     0  0
  8 12  1  0     0  0
 12 13  1  0     0  0
 13 14  2  0     0  0
 14 15  1  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
  3 27  2  0     0  0
 27 28  1  0     0  0
 28 29  1  0     0  0
 29 30  1  0     0  0
 30 31  2  0     0  0
 31 32  1  0     0  0
 32 33  1  0     0  0
 33 34  1  0     0  0
 34 35  1  0     0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  0     0  0
 39 40  1  0     0  0
 40 41  1  0     0  0
 41 42  1  0     0  0
 31 43  1  0     0  0
 12 44  1  1     0  0
M  END
> <LM_ID>
LMSP02010231

> <COMMON_NAME>
Cer(d20:2(4E,8E)(9Me)/16:1(3E)(2OH[R]))

> <SYSTEMATIC_NAME>
N-(2R-hydroxy-3E-hexadecenoyl)-9-methyl-eicosasphinga-4E,8E,dienine

> <FORMULA>
C37H69NO4

> <MASS>
591.52

> <CATEGORY>
Sphingolipids [SP]

> <MAIN_CLASS>
Ceramides [SP02]

> <SUB_CLASS>
N-acylsphingosines (ceramides) [SP0201]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Asperamide A

> <INCHI_KEY>
VRIIXNNVXVVXAW-SQQMQPSLSA-N

> <INCHI>
InChI=1S/C37H69NO4/c1-4-6-8-10-12-14-15-16-18-20-22-26-31-36(41)37(42)38-34(32-39)35(40)30-27-23-25-29-33(3)28-24-21-19-17-13-11-9-7-5-2/h26-27,29-31,34-36,39-41H,4-25,28,32H2,1-3H3,(H,38,42)/b30-27+,31-26+,33-29+/t34-,35+,36+/m0/s1

> <SMILES>
[C@](CO)([H])(NC([C@H](O)/C=C/CCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C(\C)/CCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
200077

> <ABBREVIATION>
Cer 37:3;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
139583912

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
448385; 5061

> <CITATION>
21321121; 17605063

$$$$