KEGG   COMPOUND: C03240
Entry
C03240                      Compound                               
Name
6-Deoxyerythronolide B
Formula
C21H38O6
Exact mass
386.2668
Mol weight
386.5228
Structure
Reaction
Pathway
map00522  Biosynthesis of 12-, 14- and 16-membered macrolides
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00774  Erythromycin biosynthesis, propanoyl-CoA + methylmalonyl-CoA => deoxyerythronolide B => erythromycin A/B
Enzyme
1.14.15.35      2.3.1.94
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK04 Macrolides and lactone polyketides
   C03240  6-Deoxyerythronolide B
Other DBs
CAS: 15797-36-1
PubChem: 6110
ChEBI: 16089
LIPIDMAPS: LMPK04000002
PDB-CCD: DEB[PDBj]
3DMET: B01642
NIKKAJI: J96.988E
KCF data

ATOM        27
            1   C1y C    22.4203  -18.1701
            2   C1y C    22.4203  -16.7659
            3   O7x O    23.6322  -18.8693
            4   C1b C    21.2027  -18.8517
            5   C1y C    23.6322  -16.0611
            6   C1a C    21.2027  -16.0611
            7   C7x C    23.6322  -20.2733
            8   C1a C    21.1910  -20.2616
            9   C1y C    23.6322  -14.6628
            10  O1a O    24.8440  -16.7602
            11  C1y C    24.8499  -20.9724
            12  O6a O    22.4203  -20.9724
            13  C5x C    24.8499  -13.9637
            14  C1a C    22.4203  -13.9637
            15  C1y C    26.0616  -20.2733
            16  C1a C    24.8499  -22.3707
            17  C1y C    26.0616  -14.6628
            18  O5x O    24.8499  -12.5654
            19  C1y C    26.0616  -18.8693
            20  O1a O    27.2617  -20.9724
            21  C1x C    26.0616  -16.0611
            22  C1a C    27.2734  -13.9637
            23  C1y C    27.2734  -18.1701
            24  C1a C    24.8440  -17.8201
            25  C1y C    27.2734  -16.7659
            26  O1a O    28.4736  -18.8693
            27  C1a C    28.4736  -16.0611
BOND        27
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    7  11 1
            11    7  12 2
            12    9  13 1
            13    9  14 1 #Up
            14   11  15 1
            15   11  16 1 #Up
            16   13  17 1
            17   13  18 2
            18   15  19 1
            19   15  20 1 #Down
            20   17  21 1
            21   17  22 1 #Down
            22   19  23 1
            23   19  24 1 #Down
            24   21  25 1
            25   23  26 1 #Down
            26   25  27 1 #Down
            27   23  25 1

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