| Entry |
|
|---|
| Name |
Tetracenomycin B2;
8-Demethyltetracenomycin A2
|
|---|
| Formula |
C22H16O8
|
|---|
| Exact mass |
408.0845
|
|---|
| Mol weight |
408.3576
|
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| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01057 | Biosynthesis of type II polyketide products |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00783 | Tetracenomycin C/8-demethyltetracenomycin C biosynthesis, tetracenomycin F2 => tetracenomycin C/8-demethyltetracenomycin C |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1312 Other aromatic polyketides
C12378 Tetracenomycin B2
|
|---|
| Other DBs |
|
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| LinkDB |
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| KCF data |
ATOM 30
1 C8x C 25.7357 -15.8196
2 C8y C 19.8184 -16.4929
3 C8x C 21.0084 -15.8169
4 C8y C 22.1885 -16.4929
5 C5x C 23.3785 -15.8265
6 C8y C 24.5587 -16.5022
7 C8x C 19.8143 -17.9934
8 C8y C 26.9195 -16.5118
9 C8x C 28.1092 -15.8265
10 C8y C 29.2896 -16.5118
11 C8y C 20.9988 -18.6788
12 C8y C 22.1792 -18.0028
13 C5x C 23.3689 -18.6882
14 C8y C 24.5493 -18.0124
15 C8y C 25.7295 -18.6978
16 C8y C 26.9799 -18.0220
17 C8y C 28.0996 -18.7073
18 C8y C 29.2896 -18.0220
19 O1a O 20.9892 -20.0495
20 O5x O 23.3593 -20.0588
21 O1a O 25.7295 -20.0684
22 C1a C 28.0903 -20.0684
23 O2a O 18.6286 -15.8169
24 C7a C 30.4741 -18.7000
25 O7a O 31.6655 -18.0172
26 O6a O 30.4769 -20.0707
27 O5x O 23.3689 -14.4558
28 O1a O 30.4698 -15.8361
29 C1a C 17.4396 -16.5041
30 C1a C 32.8751 -18.7204
BOND 33
1 1 8 2
2 15 16 2
3 4 5 1
4 16 17 1
5 8 9 1
6 17 18 2
7 11 19 1
8 9 10 2
9 13 20 2
10 5 6 1
11 15 21 1
12 7 11 1
13 17 22 1
14 6 1 1
15 2 23 1
16 4 12 1
17 6 14 2
18 8 16 1
19 10 18 1
20 11 12 2
21 18 24 1
22 3 4 2
23 24 25 1
24 12 13 1
25 24 26 2
26 2 7 2
27 5 27 2
28 13 14 1
29 10 28 1
30 2 3 1
31 23 29 1
32 14 15 1
33 25 30 1
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