KEGG   COMPOUND: C00831Help
Entry
C00831                      Compound                               

Name
Pantetheine;
(R)-Pantetheine
Formula
C11H22N2O4S
Exact mass
278.13
Mol weight
278.3684
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Pathway
Carbapenem biosynthesis
Pantothenate and CoA biosynthesis
Biosynthesis of antibiotics
Enzyme
2.7.1.33        2.7.1.34        3.1.3.-         3.5.1.92        
4.1.1.30
Other DBs
CAS: 
496-65-1
PubChem: 
ChEBI: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        18
            1   O1a O    17.5000  -20.5800
            2   C1b C    18.7124  -19.8800
            3   C1d C    19.9249  -20.5800
            4   C1c C    21.1373  -19.8800
            5   C5a C    22.3497  -20.5800
            6   N1b N    23.5622  -19.8800
            7   C1b C    24.7746  -20.5800
            8   C1b C    25.9870  -19.8800
            9   C5a C    27.1995  -20.5800
            10  N1b N    28.4119  -19.8800
            11  C1b C    29.6244  -20.5800
            12  C1b C    30.8368  -19.8800
            13  S1a S    32.0492  -20.5800
            14  O1a O    21.1373  -18.4800
            15  O5a O    22.3497  -21.9799
            16  O5a O    27.1995  -21.9797
            17  C1a C    18.9349  -21.5699
            18  C1a C    20.9148  -21.5699
BOND        17
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13    4  14 1 #Up
            14    5  15 2
            15    9  16 2
            16    3  17 1
            17    3  18 1

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