KEGG   COMPOUND: C17377Help
Entry
C17377                      Compound                               

Name
N-Acetylthienamycin
Formula
C13H18N2O5S
Exact mass
314.0936
Mol weight
314.3574
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00332  Carbapenem biosynthesis
map01130  Biosynthesis of antibiotics
Enzyme
2.3.1.-
Other DBs
PubChem: 96023730
ChEBI: 81044
ChEMBL: CHEMBL2115201 CHEMBL346183
KNApSAcK: C00018325
NIKKAJI: J133.884F
KCF data Show

ATOM        21
            1   N1y N    24.4088  -18.6585
            2   C1y C    24.4088  -17.2638
            3   C2y C    25.7393  -19.0844
            4   C5x C    23.0026  -18.6701
            5   C1y C    23.0026  -17.2638
            6   C1x C    25.7334  -16.8378
            7   C2y C    26.5563  -17.9582
            8   C6a C    26.1769  -20.4149
            9   O5x O    21.9987  -19.6564
            10  C1c C    21.7830  -16.5577
            11  S2a S    27.9566  -17.9582
            12  O6a O    27.5424  -20.7009
            13  O6a O    25.2433  -21.4536
            14  C1a C    20.5750  -17.2580
            15  O1a O    21.7771  -15.1572
            16  C1b C    29.1588  -17.2580
            17  C1b C    30.3668  -17.9465
            18  N1b N    31.5746  -17.2523
            19  C5a C    32.7721  -17.9470
            20  C1a C    33.9954  -17.2439
            21  O5a O    32.7685  -19.3745
BOND        22
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    7  11 1
            11    8  12 1
            12    8  13 2
            13   10  14 1
            14   10  15 1 #Up
            15   11  16 1
            16   16  17 1
            17   17  18 1
            18    4   5 1
            19    6   7 1
            20   18  19 1
            21   19  20 1
            22   19  21 2

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