KEGG   COMPOUND: C15694
Entry
C15694                      Compound                               
Name
Epothilone C
Formula
C26H39NO5S
Exact mass
477.2549
Mol weight
477.6566
Structure
Sequence
0 Mao  1 Cys  2 Mtk  3 Mad  4 Mae  5 Mae  6 Mtk  7 Mtn  8 Isk
9 Man
  Gene
0 epoA [UP:Q9KJ00]; 1 epoB [UP:Q9KIZ9]; 2 epoC [UP:Q9KIZ8];
3-6 epoD [UP:Q9KIZ7]; 7-8 epoE [UP:Q9KIZ6]; 9 epoF [UP:Q9KIZ5]
  Organism
Polyangium cellulosum (Sorangium cellulosum)
  Type
PKNRP
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK04 Macrolides and lactone polyketides
   C15694  Epothilone C
  PK14 Non-ribosomal peptide/polyketide hybrids
   C15694  Epothilone C
Other DBs
PubChem: 47205020
ChEBI: 80029
KNApSAcK: C00028252
NIKKAJI: J1.005.243B
KCF data

ATOM        33
            1   C8y C    10.9200  -12.5300
            2   C8x C    10.9200  -11.1300
            3   C2b C    12.1800  -13.2300
            4   C2c C    13.3700  -12.5300
            5   C1y C    14.5600  -13.2300
            6   C1x C    15.8200  -12.5300
            7   C2x C    15.8200  -11.1300
            8   C2x C    17.0100  -10.4300
            9   C1x C    18.2000  -11.1300
            10  C1x C    19.4600  -10.4300
            11  C1x C    20.6500  -11.1300
            12  C1y C    20.6500  -12.5300
            13  C1y C    21.9100  -13.2300
            14  C1y C    21.9100  -14.6300
            15  C5x C    20.6500  -15.3300
            16  C1z C    19.4600  -14.6300
            17  C1y C    18.2000  -15.3300
            18  C1x C    17.0100  -14.6300
            19  C7x C    15.8200  -15.4000
            20  O7x O    14.5600  -14.7000
            21  O6a O    15.8200  -16.8000
            22  O1a O    23.1000  -12.5300
            23  O5x O    20.6500  -16.7300
            24  C1a C    23.1000  -15.3300
            25  C1a C    13.3700  -11.1300
            26  O1a O    18.2000  -16.8000
            27  C1a C    20.3000  -13.9300
            28  C1a C    18.4100  -13.9300
            29  C1a C     7.3500  -11.8300
            30  C8y C     8.7500  -11.8300
            31  N5x N     9.5900  -13.0200
            32  S2x S     9.5900  -10.7100
            33  C1a C    19.3200  -12.8800
BOND        34
            1    18  19 1
            2     9  10 1
            3    19  20 1
            4     1   3 1
            5    19  21 2
            6    10  11 1
            7    13  22 1 #Down
            8     5   6 1
            9    15  23 2
            10   11  12 1
            11   14  24 1 #Up
            12    1   2 2
            13    4  25 1
            14   12  13 1
            15    6   7 1
            16   17  26 1 #Up
            17    5  20 1
            18   13  14 1
            19   16  27 1
            20    3   4 2
            21   16  28 1
            22   14  15 1
            23    7   8 2
            24   29  30 1
            25   15  16 1
            26   30  31 2
            27   32  30 1
            28    2  32 1
            29    1  31 1
            30   16  17 1
            31   12  33 1 #Up
            32    8   9 1
            33   17  18 1
            34    5   4 1 #Down

» Japanese version

  All links  
Chemical substance (4)   
   PubChem (1)   
   ChEBI (1)   
   KNApSAcK (1)   
   NIKKAJI (1)   
All databases (4)   

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