KEGG   COMPOUND: C04201Help
Entry
C04201                      Compound                               

Name
L-Tyrosine methyl ester 4-sulfate
Formula
C10H13NO6S
Exact mass
275.0464
Mol weight
275.2783
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
Other DBs
PubChem: 6874
ChEBI: 18103
NIKKAJI: J2.747.626K
KCF data Show

ATOM        18
            1   C8y C    25.1714  -17.7024
            2   C8x C    25.1714  -19.0805
            3   C8x C    23.9765  -17.0132
            4   C8x C    23.9765  -19.7759
            5   C8x C    22.7944  -17.7024
            6   C8y C    22.7944  -19.0741
            7   O2a O    21.5996  -19.7759
            8   S4a S    20.2213  -19.8395
            9   O1d O    20.2277  -18.4613
            10  O1d O    18.8494  -19.8395
            11  O1d O    20.2151  -21.2114
            12  C1b C    26.4124  -17.0100
            13  C1c C    27.6249  -17.7100
            14  C7a C    28.8373  -17.0100
            15  O7a O    30.0497  -17.7100
            16  C1a C    31.2622  -17.0100
            17  O6a O    28.8373  -15.6100
            18  N1a N    27.6249  -19.1098
BOND        18
            1     1   2 1
            2     1   3 2
            3     2   4 2
            4     3   5 1
            5     4   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     8  10 2
            10    8  11 2
            11    5   6 2
            12    1  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   14  17 2
            18   13  18 1 #Up

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