| Entry |
|
|---|
| Name |
|
|---|
| Formula |
C28H47NO8
|
|---|
| Exact mass |
525.3302
|
|---|
| Mol weight |
525.67
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map00522 | Biosynthesis of 12-, 14- and 16-membered macrolides |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK04 Macrolides and lactone polyketides
C20739 Neopikromycin
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 37
1 C1y C 21.5782 -17.4046
2 C1y C 21.5707 -18.8746
3 C1y C 22.8401 -19.6161
4 C1x C 24.1167 -18.8874
5 C1y C 24.1242 -17.4174
6 O2x O 22.8549 -16.6760
7 C1a C 25.4009 -16.6891
8 N1c N 22.8326 -21.0860
9 O1a O 20.2938 -19.6032
10 C1a C 21.5559 -21.8146
11 C1a C 24.1019 -21.8274
12 O2a O 20.3053 -16.6612
13 C1y C 19.1006 -15.9705
14 C1y C 19.0883 -14.5819
15 C1x C 17.8963 -13.9059
16 C1a C 20.2618 -13.8937
17 C1y C 17.8963 -12.5482
18 C5x C 16.7105 -11.8860
19 C1a C 19.0514 -11.8922
20 C2x C 15.5430 -12.5482
21 O5x O 16.7105 -10.5327
22 C2x C 15.5430 -13.9059
23 C1y C 14.3450 -14.5819
24 C1c C 13.1407 -16.6463
25 C1y C 14.3266 -15.9459
26 C1a C 13.1775 -13.9059
27 O7x O 15.4368 -16.6300
28 C1y C 17.8962 -16.6614
29 C1a C 16.6861 -15.9612
30 C5x C 17.9515 -18.0475
31 C7x C 15.4984 -17.9880
32 O6a O 14.3181 -18.6597
33 C1y C 16.6700 -18.6743
34 O5x O 19.0428 -18.7625
35 C1a C 16.6566 -20.0222
36 O1a O 11.9252 -15.9605
37 C1a C 13.1407 -18.0463
BOND 38
1 1 12 1 #Down
2 5 6 1
3 6 1 1
4 13 14 1
5 14 15 1
6 14 16 1 #Down
7 15 17 1
8 17 18 1
9 17 19 1 #Down
10 18 20 1
11 18 21 2
12 20 22 2
13 22 23 1
14 23 25 1
15 23 26 1 #Down
16 25 24 1 #Down
17 25 27 1
18 5 7 1 #Down
19 1 2 1
20 13 28 1
21 3 8 1 #Down
22 28 29 1 #Down
23 2 3 1
24 28 30 1
25 2 9 1 #Up
26 27 31 1
27 3 4 1
28 31 32 2
29 8 10 1
30 31 33 1
31 33 30 1
32 4 5 1
33 30 34 2
34 8 11 1
35 33 35 1 #Up
36 13 12 1 #Down
37 24 36 1 #Up
38 24 37 1
|
|---|
