KEGG   COMPOUND: C00919
Entry
C00919                      Compound                               
Name
Choline sulfate
Formula
C5H13NO4S
Exact mass
183.0565
Mol weight
183.226
Structure
Reaction
R01027 R01028
Pathway
map02010  ABC transporters
Enzyme
2.8.2.6         3.1.6.6
Other DBs
CAS: 4858-96-2
PubChem: 4173
ChEBI: 16822
KNApSAcK: C00001530
3DMET: B00199
NIKKAJI: J814.134G
LinkDB
KCF data

ATOM        11
            1   C1b C    22.9407  -16.8746
            2   N1d N    24.2912  -16.8746 #+
            3   C1b C    22.2655  -15.7045
            4   C1a C    25.2524  -18.4003
            5   C1a C    25.1824  -15.3545
            6   C1a C    26.0432  -16.8978
            7   O2a O    20.9093  -15.7045
            8   S4a S    19.5529  -15.7103
            9   O1d O    19.5413  -14.2841
            10  O1d O    18.2084  -15.7045
            11  O1d O    19.5529  -17.0607 #-
BOND        10
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     7   8 1
            8     8   9 2
            9     8  10 2
            10    8  11 1

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