KEGG   COMPOUND: C03112Help
Entry
C03112                      Compound                               

Name
Deacetylcephalosporin C
Formula
C14H19N3O7S
Exact mass
373.0944
Mol weight
373.3816
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Penicillin and cephalosporin biosynthesis
Metabolic pathways
Biosynthesis of antibiotics
Module
M00673  
Cephamycin C biosynthesis, aminoadipate + cycteine + valine => cephamycin C
Enzyme
1.14.11.26      2.1.3.7         2.3.1.175       3.1.1.41
Other DBs
CAS: 
1476-46-6
PubChem: 
ChEBI: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        25
            1   N1y N    28.4113  -18.1623
            2   C1y C    28.4113  -16.7724
            3   C2y C    29.6100  -18.8828
            4   C5x C    27.0214  -18.1623
            5   C1y C    27.0214  -16.7724
            6   S2x S    29.6100  -16.0838
            7   C2y C    30.8279  -18.1751
            8   C6a C    29.5973  -20.0597
            9   O5x O    26.0395  -19.1444
            10  N1b N    25.2861  -16.5540
            11  C1x C    30.8279  -16.7724
            12  C1b C    32.0266  -18.8702
            13  O6a O    28.3922  -20.7419
            14  O6a O    30.7960  -20.7610
            15  C5a C    23.6610  -15.5036
            16  O1a O    33.2317  -18.1751
            17  C1b C    22.4624  -16.1986
            18  O5a O    23.6610  -14.2557
            19  C1b C    21.2572  -15.5036
            20  C1b C    20.0586  -16.1986
            21  C1c C    18.8599  -15.5036
            22  C6a C    17.6549  -16.1986
            23  N1a N    18.8599  -14.3268
            24  O6a O    16.4561  -15.4973
            25  O6a O    17.6612  -17.5823
BOND        26
            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 #Up
            10    6  11 1
            11    7  12 1
            12    8  13 1
            13    8  14 2
            14   10  15 1
            15   12  16 1
            16   15  17 1
            17   15  18 2
            18   17  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   21  23 1 #Down
            23   22  24 1
            24   22  25 2
            25    4   5 1
            26    7  11 1

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