| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C52H76O24
|
|---|
| Exact mass |
1084.4727
|
|---|
| Mol weight |
1085.14
|
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| Structure |
|
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| Remark |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01057 | Biosynthesis of type II polyketide products |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Module |
| M00782 | Mithramycin biosynthesis, 4-demethylpremithramycinone => mithramycin |
|
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1312 Other aromatic polyketides
C12389 Mithramycin
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C12389
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01D CYTOTOXIC ANTIBIOTICS AND RELATED SUBSTANCES
L01DC Other cytotoxic antibiotics
L01DC02 Plicamycin
D00468 Plicamycin (USAN/INN)
|
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| Other DBs |
|
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| LinkDB |
|
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| KCF data |
ATOM 76
1 C1y C 36.5380 -29.4230
2 O2x O 35.3285 -28.7769
3 C1y C 34.1614 -29.5032
4 C1y C 34.1368 -30.8771
5 C1z C 35.4163 -31.5231
6 C1x C 36.5146 -30.7968
7 C1y C 38.7977 -25.2168
8 O2x O 37.6006 -24.5772
9 C1y C 36.4334 -25.3033
10 C1y C 36.4086 -26.6771
11 C1y C 37.6756 -27.3168
12 C1x C 38.7741 -26.5907
13 O2a O 37.7208 -28.6871
14 C1y C 41.0633 -21.0204
15 O2x O 39.8487 -20.3527
16 C1y C 38.6731 -21.0649
17 C1y C 38.6332 -22.4392
18 C1y C 39.9165 -23.1068
19 C1x C 41.0922 -22.3946
20 C1y C 30.2598 -19.7618
21 O2x O 29.0777 -19.0793
22 C1y C 27.8872 -19.7666
23 C1y C 27.8873 -21.1412
24 C1y C 29.0694 -21.8237
25 C1x C 30.2598 -21.1364
26 C1y C 30.2763 -15.6284
27 C1y C 30.2763 -17.0031
28 C1y C 31.4667 -17.6903
29 C1x C 32.6572 -17.0031
30 C1y C 32.6572 -15.6284
31 O2x O 31.4667 -14.9412
32 C8y C 35.0380 -17.0031
33 C8y C 35.0380 -15.6284
34 O2a O 33.8477 -14.9412
35 C8y C 36.2286 -17.6903
36 C8y C 37.4190 -17.0031
37 C8y C 37.4190 -15.6284
38 C8x C 36.2286 -14.9412
39 C8y C 38.6094 -17.6903
40 C8y C 39.7999 -17.0031
41 C8y C 39.7999 -15.6284
42 C8x C 38.6094 -14.9412
43 C5x C 40.9903 -17.6903
44 C1y C 42.1808 -17.0031
45 C1y C 42.1808 -15.6284
46 C1x C 40.9903 -14.9412
47 C1a C 29.0859 -14.9412
48 O2a O 31.4667 -19.0648
49 O1a O 29.0859 -17.6903
50 O5a O 44.5617 -17.0031
51 C5a C 44.5617 -15.6284
52 C1c C 43.3713 -14.9412
53 O1a O 46.9427 -17.0031
54 C1c C 46.9427 -15.6284
55 C1c C 45.7522 -14.9412
56 O2a O 42.2496 -20.3021
57 O2a O 43.3713 -13.5669
58 O5x O 40.9903 -19.0650
59 O1a O 38.6094 -19.0649
60 O1a O 36.2286 -19.0647
61 O1a O 45.7522 -13.5665
62 C1a C 48.1077 -14.9554
63 C1a C 42.2053 -12.8935
64 C1a C 37.4737 -20.3661
65 O2a O 39.9617 -24.4932
66 O1a O 29.0692 -23.1885
67 C1a C 26.6782 -19.0687
68 O1a O 26.6908 -21.8321
69 O1a O 37.4718 -23.1216
70 C1a C 35.2500 -24.6710
71 C1a C 32.9780 -28.8709
72 C1a C 34.4443 -32.7013
73 O1a O 36.3884 -32.7013
74 O1a O 33.0260 -31.6117
75 O1a O 35.2918 -27.4152
76 C1a C 33.8332 -17.6988
BOND 83
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 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 7 12 1
13 11 13 1 #Up
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 14 19 1
20 20 21 1
21 21 22 1
22 22 23 1
23 23 24 1
24 24 25 1
25 20 25 1
26 26 27 1
27 27 28 1
28 28 29 1
29 29 30 1
30 30 31 1
31 26 31 1
32 32 33 2
33 33 34 1
34 32 35 1
35 35 36 2
36 36 37 1
37 37 38 2
38 33 38 1
39 36 39 1
40 39 40 2
41 40 41 1
42 41 42 2
43 37 42 1
44 40 43 1
45 43 44 1
46 44 45 1
47 45 46 1
48 41 46 1
49 30 34 1 #Up
50 26 47 1 #Up
51 28 48 1 #Up
52 27 49 1 #Down
53 50 51 2
54 51 52 1
55 45 52 1
56 54 55 1
57 51 55 1
58 44 56 1 #Down
59 52 57 1 #Down
60 43 58 2
61 39 59 1
62 35 60 1
63 54 53 1 #Up
64 55 61 1 #Up
65 54 62 1
66 57 63 1
67 20 48 1 #Up
68 14 56 1 #Up
69 16 64 1 #Up
70 18 65 1 #Up
71 24 66 1 #Up
72 22 67 1 #Up
73 23 68 1 #Down
74 17 69 1 #Down
75 7 65 1 #Up
76 1 13 1 #Up
77 9 70 1 #Up
78 3 71 1 #Up
79 5 72 1 #Up
80 5 73 1 #Down
81 4 74 1 #Down
82 10 75 1 #Up
83 32 76 1
|
|---|
