KEGG   COMPOUND: C11072
Entry
C11072                      Compound                               
Name
THTA;
2-Tetrahydrothiopheneacetic acid
Formula
C6H10O2S
Exact mass
146.0402
Mol weight
146.2074
Structure
Other DBs
PubChem: 13254
ChEBI: 9383
NIKKAJI: J228.021C
LinkDB
KCF data

ATOM        9
            1   C1y C    27.3017  -19.2287
            2   C1b C    28.5115  -18.5253
            3   C6a C    29.7214  -19.2287
            4   O6a O    30.9313  -18.5253
            5   C1x C    26.8726  -20.5582
            6   S2x S    26.1691  -18.3987
            7   C1x C    25.0394  -19.2274
            8   C1x C    25.4728  -20.5582
            9   O6a O    29.7843  -20.6284
BOND        9
            1     2   3 1
            2     1   2 1
            3     3   4 1
            4     5   1 1
            5     1   6 1
            6     6   7 1
            7     7   8 1
            8     8   5 1
            9     3   9 2

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