KEGG   COMPOUND: C01134
Entry
C01134                      Compound                               
Name
Pantetheine 4'-phosphate;
4'-Phosphopantetheine;
Phosphopantetheine;
D-Pantetheine 4'-phosphate
Formula
C11H23N2O7PS
Exact mass
358.0964
Mol weight
358.3483
Structure
Reaction
Pathway
map00332  Carbapenem biosynthesis
map00770  Pantothenate and CoA biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
map01240  Biosynthesis of cofactors
Module
M00120  Coenzyme A biosynthesis, pantothenate => CoA
M00914  Coenzyme A biosynthesis, archaea, 2-oxoisovalerate => 4-phosphopantoate => CoA
Enzyme
2.3.1.49        2.7.1.33        2.7.1.34        2.7.7.3         
3.1.3.-         3.1.4.14        3.6.1.9         3.6.1.-         
4.1.1.36
Other DBs
PubChem: 4365
ChEBI: 16858 4222
PDB-CCD: PNS[PDBj]
3DMET: B04774
NIKKAJI: J1.112.929C
LinkDB
KCF data

ATOM        22
            1   C1c C    26.6104  -16.6425
            2   C5a C    27.8096  -17.3349
            3   N1b N    29.0087  -16.6425
            4   C1b C    30.2079  -17.3349
            5   C1b C    31.4070  -16.6425
            6   C5a C    32.6062  -17.3349
            7   N1b N    33.8053  -16.6425
            8   C1b C    35.0046  -17.3349
            9   C1b C    36.2037  -16.6425
            10  S1a S    37.4273  -17.3493
            11  O5a O    32.6062  -18.7193
            12  O5a O    27.8096  -18.7195
            13  O1a O    26.6104  -15.2578
            14  C1d C    25.3825  -17.3512
            15  C1b C    24.1946  -16.6651
            16  C1a C    24.3926  -18.3412
            17  C1a C    26.5125  -18.3412
            18  O2b O    23.0034  -17.3527
            19  P1b P    21.6034  -17.3527
            20  O1c O    20.2034  -17.3527
            21  O1c O    21.6035  -15.9603
            22  O1c O    21.6033  -18.7597
BOND        21
            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    6  11 2
            11    2  12 2
            12    1  13 1 #Up
            13    1  14 1
            14   14  15 1
            15   14  16 1
            16   14  17 1
            17   15  18 1
            18   18  19 1
            19   19  20 1
            20   19  21 1
            21   19  22 2

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