KEGG   COMPOUND: C18642
Entry
C18642                      Compound                               
Name
beta-Rhodomycin;
Rhodomycin B
Formula
C28H33NO10
Exact mass
543.2104
Mol weight
543.5623
Structure
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01110  Biosynthesis of secondary metabolites
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK13 Aromatic polyketides
   PK1305 Anthracyclinones
    C18642  Rhodomycin B
Secondary metabolites in pathway maps [br08011.html]
 Biosynthetic pathways and modules of secondary metabolites
  C18642
Other DBs
CAS: 1404-52-0
PubChem: 124489316
ChEBI: 81879
KNApSAcK: C00018600
LinkDB
KCF data

ATOM        39
            1   C1y C    26.5722  -21.9109
            2   C1y C    26.5722  -23.2836
            3   C1y C    27.7390  -23.9699
            4   C1x C    28.9744  -23.2836
            5   C1y C    28.9744  -21.9109
            6   O2x O    27.7390  -21.2246
            7   C1a C    25.4054  -21.2246
            8   O1a O    25.4054  -23.9699
            9   N1c N    27.7390  -25.3426
            10  C1a C    26.5722  -26.0289
            11  C1a C    28.9058  -26.0289
            12  O2a O    30.1412  -21.2246
            13  C8x C    21.8365  -16.4888
            14  C8x C    21.8365  -17.8615
            15  C8y C    23.0033  -18.5479
            16  C8y C    24.2387  -17.8615
            17  C8y C    24.2387  -16.4888
            18  C8x C    23.0033  -15.8025
            19  C5x C    25.4054  -18.5479
            20  C8y C    26.5722  -17.8615
            21  C8y C    26.5722  -16.4888
            22  C5x C    25.4054  -15.8025
            23  C8y C    27.8076  -18.5479
            24  C8y C    28.9744  -17.8615
            25  C8y C    28.9744  -16.4888
            26  C8y C    27.8076  -15.8025
            27  C1y C    30.1412  -18.5479
            28  C1x C    31.3766  -17.8615
            29  C1z C    31.3766  -16.4888
            30  C1y C    30.1412  -15.8025
            31  O5x O    25.4054  -14.4298
            32  O5x O    25.4054  -19.9205
            33  O1a O    23.0033  -19.9205
            34  O1a O    27.8076  -19.9205
            35  O1a O    30.1412  -14.4298
            36  O1a O    32.5434  -17.1752
            37  C1b C    32.5434  -15.8025
            38  C1a C    32.5434  -14.4298
            39  O1a O    27.8244  -14.4204
BOND        43
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     1   7 1 #Down
            8     2   8 1 #Down
            9     3   9 1 #Down
            10    9  10 1
            11    9  11 1
            12    5  12 1 #Up
            13   13  14 1
            14   14  15 2
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   13  18 2
            19   16  19 1
            20   19  20 1
            21   20  21 2
            22   21  22 1
            23   17  22 1
            24   20  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   21  26 1
            29   24  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   25  30 1
            34   22  31 2
            35   19  32 2
            36   15  33 1
            37   23  34 1
            38   27  12 1 #Down
            39   30  35 1 #Up
            40   29  36 1 #Down
            41   29  37 1 #Up
            42   37  38 1
            43   26  39 1

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