KEGG   COMPOUND: C04445
Entry
C04445                      Compound                               
Name
3,4-Dehydrothiomorpholine-3-carboxylate
Formula
C5H7NO2S
Exact mass
145.0197
Mol weight
145.1796
Structure
Reaction
Enzyme
Other DBs
PubChem: 7074
ChEBI: 27626
3DMET: B00716
NIKKAJI: J2.041.005A
LinkDB
KCF data

ATOM        9
            1   C2y C    18.0553  -17.2400
            2   C1x C    18.0553  -15.8319
            3   N2x N    16.8328  -17.9505
            4   C6a C    19.2649  -17.9312
            5   S2x S    16.8328  -15.1342
            6   C1x C    15.6294  -17.2400
            7   O6a O    19.2586  -19.3265
            8   O6a O    20.4618  -17.2337
            9   C1x C    15.6294  -15.8319
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 2
            8     5   9 1
            9     6   9 1

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