KEGG   COMPOUND: C10917
Entry
C10917                      Compound                               
Name
7-N,N-Dimethylamino-1,2,3,4,5-pentathiocyclooctane;
PTCA
Formula
C5H11NS5
Exact mass
244.9495
Mol weight
245.4725
Structure
Other DBs
PubChem: 13100
ChEBI: 2277
NIKKAJI: J658.265F
LinkDB
KCF data

ATOM        11
            1   S3x S    29.2800  -16.1621
            2   S3x S    30.6767  -16.7066
            3   S3x S    31.2939  -17.9347
            4   S3x S    30.7541  -19.3209
            5   S3x S    29.4386  -19.7790
            6   C1x C    28.1295  -16.7816
            7   C1y C    27.7447  -18.0113
            8   C1x C    28.2838  -19.2401
            9   N1c N    26.4641  -18.0831
            10  C1a C    25.5132  -16.7808
            11  C1a C    25.6675  -19.4003
BOND        11
            1     1   6 1
            2     1   2 1
            3     6   7 1
            4     7   8 1
            5     3   4 1
            6     5   8 1
            7     7   9 1
            8     4   5 1
            9     9  10 1
            10    2   3 1
            11    9  11 1

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