KEGG   COMPOUND: C04515
Entry
C04515                      Compound                               
Name
(3S)-3-Hydroxyacyl-N-acylthioethanolamine
Formula
C6H9NO3SR2
Structure
Other DBs
PubChem: 7128
ChEBI: 209
KCF data

ATOM        13
            1   R   R    14.6300  -16.5200
            2   C5a C    15.8424  -15.8200
            3   N1b N    17.0549  -16.5200
            4   C1b C    18.2673  -15.8200
            5   C1b C    19.4797  -16.5200
            6   S2a S    20.6922  -15.8200
            7   C5a C    21.9046  -16.5200
            8   C1b C    23.1170  -15.8200
            9   C1c C    24.3295  -16.5200
            10  O1a O    25.5419  -15.8200
            11  O5a O    15.8424  -14.4202
            12  O5a O    21.9046  -17.9200
            13  R   R    24.3295  -17.9197
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1 #Up
            10    2  11 2
            11    7  12 2
            12    9  13 1

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  All links  
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
All databases (2)   

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