| Entry |
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|---|
| Name |
7,9,12-Octaketide intermediate 2
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| Formula |
C16H19O8SR
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| Structure |
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| Comment |
Generic compound in reaction hierarchy
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| Reaction |
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| Pathway |
| map01056 | Biosynthesis of type II polyketide backbone |
| map01110 | Biosynthesis of secondary metabolites |
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| Module |
| M00778 | Type II polyketide backbone biosynthesis, acyl-CoA + malonyl-CoA => polyketide |
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| Enzyme |
1.1.1.- 4.2.1.-
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| Other DBs |
|
|---|
| KCF data |
ATOM 26
1 C1y C 14.1400 -17.5000
2 C1x C 14.1400 -18.9000
3 C5x C 15.3524 -19.6000
4 C1y C 16.5649 -18.9000
5 C1z C 16.5649 -17.5000
6 C1x C 15.3524 -16.8000
7 C5a C 18.3624 -19.9500
8 C1b C 19.5749 -19.2500
9 C5a C 20.7873 -19.9500
10 C1a C 21.9997 -19.2500
11 C1b C 18.2224 -16.2400
12 C5a C 19.4349 -16.9400
13 C1b C 20.6473 -16.2400
14 C5a C 21.8597 -16.9400
15 C1b C 23.0722 -16.2400
16 C5a C 24.2846 -16.9400
17 S2a S 25.4970 -16.2400
18 O1a O 12.9276 -16.8000
19 O1a O 16.5649 -16.1000
20 O5a O 18.3589 -21.3499
21 O5x O 15.3524 -20.9998
22 O5a O 20.7873 -21.3500
23 O5a O 19.4349 -18.1998
24 O5a O 21.8597 -18.1999
25 O5a O 24.2846 -18.2000
26 R R 26.8970 -16.2400
BOND 26
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 1 18 1
19 5 19 1
20 7 20 2
21 3 21 2
22 9 22 2
23 12 23 2
24 14 24 2
25 16 25 2
26 17 26 1
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