KEGG   COMPOUND: C11585
Entry
C11585                      Compound                               
Name
4-Methylumbelliferone sulfate;
4-Methylumbelliferyl sulfate
Formula
C10H8O6S
Exact mass
256.0042
Mol weight
256.2319
Structure
Other DBs
CAS: 25892-63-1
PubChem: 13750
ChEBI: 1905
PDB-CCD: MUX[PDBj]
NIKKAJI: J387.587C
LinkDB
KCF data

ATOM        17
            1   O2a O    26.5984  -15.5234
            2   C8y C    30.2177  -16.2052
            3   C8y C    30.2177  -17.6214
            4   O7x O    31.4242  -15.5058
            5   C8x C    28.9996  -15.5234
            6   C8y C    31.4416  -18.3208
            7   C8x C    28.9996  -18.3267
            8   C8y C    32.7239  -16.1995
            9   C8y C    27.7989  -16.2052
            10  C8x C    32.6772  -17.6273
            11  C1a C    31.4416  -19.7138
            12  C8x C    27.7989  -17.6214
            13  O6a O    33.8487  -15.5117
            14  S4a S    25.2040  -15.5148
            15  O1d O    23.8096  -15.5077
            16  O1d O    25.1969  -14.1204
            17  O1d O    25.1969  -16.9092
BOND        18
            1     3   6 1
            2     3   7 1
            3     4   8 1
            4     5   9 2
            5     6  10 2
            6     6  11 1
            7     7  12 2
            8     8  13 2
            9     9   1 1
            10    8  10 1
            11    9  12 1
            12    1  14 1
            13    2   3 2
            14   14  15 2
            15    2   4 1
            16   14  16 1
            17    2   5 1
            18   14  17 2

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