KEGG   COMPOUND: C06801Help
Entry
C06801                      Compound                               

Name
Tetracenomycin C
Formula
C23H20O11
Exact mass
472.1006
Mol weight
472.3983
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00783  Tetracenomycin C/8-demethyltetracenomycin C biosynthesis, tetracenomycin F2 => tetracenomycin C/8-demethyltetracenomycin C
Enzyme
Other DBs
CAS: 71135-22-3
PubChem: 9020
ChEBI: 9470
3DMET: B02096
NIKKAJI: J479.691H
LinkDB All DBs
KCF data Show

ATOM        34
            1   C2y C    22.7493  -18.2263
            2   C2x C    22.7493  -19.6295
            3   C5x C    23.9682  -20.3346
            4   C1y C    23.9682  -17.5282
            5   C1z C    25.1801  -18.2263
            6   C1z C    25.1742  -19.6295
            7   C5x C    26.3874  -20.3397
            8   C5x C    26.3992  -17.5335
            9   C8y C    27.6122  -18.2366
            10  C8y C    27.5997  -19.6361
            11  C8y C    28.8062  -20.3503
            12  C8x C    28.8314  -17.5513
            13  C8y C    30.0311  -18.2584
            14  C8y C    30.0109  -19.6576
            15  C8y C    31.2136  -20.3781
            16  C8x C    31.2537  -17.5799
            17  C8y C    32.4562  -18.2933
            18  C8y C    32.4996  -19.6851
            19  C7a C    33.6228  -20.4075
            20  O7a O    34.8424  -19.7381
            21  O2a O    33.6757  -17.6237
            22  O5x O    23.9714  -21.7376
            23  O1a O    23.9699  -16.1252
            24  O1a O    25.1676  -16.8233
            25  O1a O    25.1607  -21.0255
            26  O2a O    21.5334  -17.5276
            27  O5x O    26.4051  -16.1305
            28  O5x O    26.3847  -21.7427
            29  O1a O    28.8657  -21.7534
            30  C1a C    31.1982  -21.7809
            31  O6a O    33.5960  -21.8104
            32  C1a C    36.0449  -20.4592
            33  C1a C    20.3240  -18.2251
            34  C1a C    34.8758  -18.3513
BOND        37
            1    16  13 1
            2     7  10 1
            3     9   8 1
            4     8   5 1
            5     5   4 1
            6     4   1 1
            7    17  18 1
            8    18  19 1
            9    19  20 1
            10   21  17 1
            11    1   2 2
            12    3  22 2
            13    9  10 2
            14    4  23 1 #Up
            15   10  11 1
            16    5  24 1 #Up
            17   11  14 2
            18    6  25 1 #Up
            19   13  12 2
            20    1  26 1
            21   12   9 1
            22    2   3 1
            23    8  27 2
            24    3   6 1
            25    7  28 2
            26    5   6 1
            27   11  29 1
            28    6   7 1
            29   15  30 1
            30   13  14 1
            31   14  15 1
            32   19  31 2
            33   20  32 1
            34   15  18 2
            35   26  33 1
            36   17  16 2
            37   21  34 1

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