KEGG   COMPOUND: C12247Help
Entry
C12247                      Compound                               

Name
Rifamycin W
Formula
C35H45NO11
Exact mass
655.2993
Mol weight
655.7319
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01051  Biosynthesis of ansamycins
map01130  Biosynthesis of antibiotics
Brite
Compounds with biological roles [BR:br08001]
 Antibiotics
  Polyketides and nonribosomal peptides
   Ansamycins
    C12247  Rifamycin W
Lipids [BR:br08002]
 PK  Polyketides
  PK05 Ansamycins and related polyketides
   C12247  Rifamycin W
BRITE hierarchy
Other DBs
CAS: 53904-81-7
PubChem: 14392
ChEBI: 32099
LIPIDMAPS: LMPK05000008
3DMET: B05621
NIKKAJI: J92.550K
KCF data Show

ATOM        47
            1   C8y C    27.7790  -23.5439
            2   C8y C    26.7552  -24.1301
            3   C8y C    27.7947  -22.3712
            4   C5x C    28.7804  -24.1456
            5   C8y C    25.7365  -23.4211
            6   C5a C    26.7552  -25.3079
            7   C5x C    28.8061  -21.8005
            8   C8y C    26.7862  -21.7231
            9   C2x C    29.8157  -23.5645
            10  O5x O    28.7700  -25.3234
            11  C8y C    25.7725  -22.2732
            12  O5a O    27.5819  -26.1470
            13  C2y C    29.8157  -22.3919
            14  O5x O    28.8216  -20.6174
            15  C1a C    25.7570  -21.0954
            16  C2c C    23.5239  -25.3683
            17  N1b N    30.8398  -21.8211
            18  C5a C    30.8501  -20.6485
            19  C2c C    31.8677  -20.0819
            20  O5a O    29.8415  -20.0572
            21  C2b C    31.8831  -18.9145
            22  C2b C    30.9562  -18.3127
            23  C1a C    32.9078  -20.7051
            24  C1a C    22.5883  -26.1475
            25  O1a O    24.7566  -24.0137
            26  O1a O    26.7761  -20.4836
            27  C2b C    30.9137  -17.0806
            28  C1c C    29.8525  -16.4360
            29  C1c C    28.8030  -17.0806
            30  C1c C    27.7476  -16.4598
            31  C1c C    26.6923  -17.0806
            32  C1c C    25.6369  -16.4598
            33  C1c C    24.5816  -17.0806
            34  C1c C    23.5262  -16.4598
            35  C1c C    22.4459  -17.0718
            36  C1c C    22.4359  -18.3135
            37  C2b C    23.4912  -18.9342
            38  O1a O    24.5714  -18.3223
            39  C1a C    29.8497  -15.2182
            40  C1a C    25.6369  -15.2182
            41  C1a C    27.7476  -15.2182
            42  O1a O    26.6923  -18.3223
            43  O1a O    28.8148  -18.3222
            44  O1a O    21.3982  -16.4554
            45  C1b C    21.2741  -18.9716
            46  C1a C    23.5377  -15.0501
            47  O1a O    20.0617  -18.2716
BOND        49
            1     2   6 1
            2     3   7 1
            3     3   8 1
            4     4   9 1
            5     4  10 2
            6     5  11 1
            7     6  12 2
            8     7  13 1
            9     7  14 2
            10   11  15 1
            11   13  17 1
            12   17  18 1
            13   18  19 1
            14   18  20 2
            15   19  21 2
            16   21  22 1
            17    8  11 2
            18    9  13 2
            19   19  23 1
            20    1   2 1
            21    1   3 2
            22   16  24 1
            23    1   4 1
            24    5  25 1
            25   16   6 1
            26    2   5 2
            27    8  26 1
            28   22  27 2
            29   27  28 1
            30   28  29 1
            31   29  30 1
            32   30  31 1
            33   31  32 1
            34   32  33 1
            35   33  34 1
            36   34  35 1
            37   35  36 1
            38   36  37 1
            39   33  38 1 #Down
            40   28  39 1 #Up
            41   32  40 1 #Down
            42   30  41 1 #Down
            43   31  42 1 #Up
            44   29  43 1 #Down
            45   35  44 1 #Down
            46   37  16 2
            47   36  45 1 #Down
            48   34  46 1 #Up
            49   45  47 1

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