KEGG   COMPOUND: C01959Help
Entry
C01959                      Compound                               

Name
Taurocyamine
Formula
C3H9N3O3S
Exact mass
167.0365
Mol weight
167.1869
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00430  Taurine and hypotaurine metabolism
Enzyme
2.1.4.1         2.7.3.4
Other DBs
CAS: 543-18-0
PubChem: 5060
ChEBI: 17228
ChEMBL: CHEMBL21832
PDB-CCD: 3S5[PDBj]
3DMET: B00373
NIKKAJI: J11.554A
KCF data Show

ATOM        10
            1   N1b N    14.7000  -19.7400
            2   C1b C    15.9124  -19.0400
            3   C1b C    17.1249  -19.7400
            4   S4a S    18.3373  -19.0400
            5   O1d O    19.5497  -19.7400
            6   O1d O    19.5373  -18.1201
            7   O1d O    17.0674  -18.1901
            8   C2c C    13.4876  -19.0400
            9   N1a N    12.2921  -19.7304
            10  N2a N    13.4875  -17.6402
BOND        9
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     4   6 2
            6     4   7 2
            7     1   8 1
            8     8   9 1
            9     8  10 2

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