| Entry |
|
|---|
| Name |
(S)-DNPA;
4-Dihydro-9-hydroxy-1-methyl-10-oxo-3-H-naphtho[2,3-c]pyran-3-acetic acid
|
|---|
| Formula |
C16H14O5
|
|---|
| Exact mass |
286.0841
|
|---|
| Mol weight |
286.28
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01057 | Biosynthesis of type II polyketide products |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00779 | Dihydrokalafungin biosynthesis, octaketide => dihydrokalafungin |
|
|---|
| Enzyme |
4.2.1.-
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 21
1 C8y C 22.1235 -17.2337
2 C8y C 22.1160 -18.6383
3 C5x C 23.3367 -16.5399
4 C8y C 20.9139 -16.5205
5 C2x C 23.3258 -19.3424
6 C8x C 20.8975 -19.3288
7 C2y C 24.4694 -17.2492
8 O5x O 23.3360 -15.1214
9 C8x C 19.6955 -17.2203
10 O1a O 20.9117 -15.1012
11 C2y C 24.5305 -18.6440
12 C8x C 19.6880 -18.6251
13 C2y C 25.7521 -16.5588
14 C1x C 25.7287 -19.3358
15 O2x O 26.9442 -17.2711
16 C1a C 25.7515 -15.1403
17 C1y C 26.9378 -18.6581
18 C1b C 28.1512 -19.3552
19 C6a C 29.3708 -18.6472
20 O6a O 30.5844 -19.3443
21 O6a O 29.3651 -17.2531
BOND 23
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 2
11 6 12 2
12 7 13 2
13 11 14 1
14 13 15 1
15 13 16 1
16 14 17 1
17 17 18 1 #Down
18 18 19 1
19 19 20 1
20 19 21 2
21 7 11 1
22 9 12 1
23 15 17 1
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|---|
