KEGG   COMPOUND: C02744Help
Entry
C02744                      Compound                               

Name
Psychosine sulfate
Formula
C24H47NO10S
Exact mass
541.2921
Mol weight
541.6957
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
Brite
Lipids [BR:br08002]
 SP  Sphingolipids
  SP08 Amphoteric glycosphingolipids
   C02744  Psychosine sulfate
BRITE hierarchy
Other DBs
PubChem: 5704
ChEBI: 17507
LIPIDMAPS: LMSP08000002
NIKKAJI: J2.739.742E
KCF data Show

ATOM        36
            1   C1y C    20.0043  -21.6884
            2   O2x O    18.7763  -20.9879
            3   C1y C    20.0043  -23.0975
            4   O2a O    21.2157  -20.9879
            5   C1y C    17.5733  -21.6884
            6   C1y C    18.7763  -23.7899
            7   O1a O    21.2157  -23.7899
            8   C1b C    21.2157  -19.5951
            9   C1y C    17.5733  -23.0975
            10  C1b C    16.3699  -20.9879
            11  O1a O    18.7763  -25.1908
            12  C1c C    22.4355  -18.8946
            13  O1a O    16.3699  -23.7899
            14  O2a O    15.2988  -21.8944
            15  C1c C    23.6386  -19.5951
            16  N1a N    22.4355  -17.4937
            17  S4a S    13.8813  -21.8861
            18  C2b C    24.8584  -18.8946
            19  O1a O    23.6386  -20.9879
            20  O1d O    13.8813  -20.4935
            21  O1d O    12.4885  -21.8861
            22  O1d O    13.8813  -23.2873
            23  C2b C    26.0699  -19.5951
            24  C1b C    27.2813  -18.8946
            25  C1b C    28.4927  -19.5951
            26  C1b C    29.7042  -18.8946
            27  C1b C    30.9238  -19.5951
            28  C1b C    32.1268  -18.8946
            29  C1b C    33.3383  -19.5951
            30  C1b C    34.5416  -18.8946
            31  C1b C    35.7695  -19.5951
            32  C1b C    36.9810  -18.8946
            33  C1b C    38.1841  -19.5951
            34  C1b C    39.3955  -18.8946
            35  C1b C    40.6153  -19.5951
            36  C1a C    41.8267  -18.8865
BOND        36
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Up
            4     2   5 1
            5     3   6 1
            6     3   7 1 #Down
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    6  11 1 #Up
            11    8  12 1
            12    9  13 1 #Up
            13   10  14 1
            14   12  15 1
            15   12  16 1 #Down
            16   14  17 1
            17   15  18 1
            18   15  19 1 #Up
            19   17  20 1
            20   17  21 2
            21   17  22 2
            22   18  23 2
            23   23  24 1
            24   24  25 1
            25   25  26 1
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  31 1
            31   31  32 1
            32   32  33 1
            33   33  34 1
            34   34  35 1
            35   35  36 1
            36    6   9 1

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