| Entry |
|
|---|
| Name |
4-Amino-anhydrotetracycline;
4-Amino-ATC;
4-Dedimethyl-6-dehydro-anhydrotetracycline;
4-Amino-4-de(dimethylamino)anhydrotetracycline
|
|---|
| Formula |
C20H18N2O7
|
|---|
| Exact mass |
398.1114
|
|---|
| Mol weight |
398.37
|
|---|
| Structure |
|
|---|
| Reaction |
|
|---|
| Pathway |
| map01057 | Biosynthesis of type II polyketide products |
| map01110 | Biosynthesis of secondary metabolites |
|
|---|
| Module |
| M00780 | Tetracycline/oxytetracycline biosynthesis, pretetramide => tetracycline/oxytetracycline |
| M00823 | Chlortetracycline biosynthesis, pretetramide => chlortetracycline |
|
|---|
| Enzyme |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK07 Linear tetracyclines
C06654 4-Dedimethyl-6-dehydro-anhydrotetracycline
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 29
1 C8y C 24.2960 -16.7475
2 C8y C 24.3076 -15.3476
3 C5x C 25.5034 -17.4533
4 C8y C 23.0826 -17.4416
5 C1x C 25.5266 -14.6534
6 C8y C 23.0943 -14.6360
7 C1z C 26.7166 -16.7650
8 O5x O 25.4917 -18.8532
9 C8y C 21.8752 -16.7359
10 O1a O 23.0710 -18.8298
11 C1y C 26.7340 -15.3650
12 C8y C 21.8811 -15.3359
13 C1a C 23.1060 -13.2301
14 C5x C 27.9123 -17.4766
15 O1a O 26.6990 -18.1590
16 C8y C 20.6678 -17.4358
17 C1y C 27.9473 -14.6827
18 C8x C 20.6678 -14.6301
19 C2y C 29.1314 -16.8000
20 O5x O 27.9590 -18.8823
21 C8x C 19.4487 -16.7359
22 O1a O 20.6678 -18.8356
23 C2y C 29.1489 -15.4001
24 N1a N 27.9414 -13.2828
25 C8x C 19.4487 -15.3359
26 C5a C 30.3389 -17.5174
27 O1a O 30.3796 -14.7177
28 N1a N 31.5637 -16.8350
29 O5a O 30.3155 -18.9173
BOND 32
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 1
11 6 12 2
12 6 13 1
13 7 14 1
14 7 15 1 #Down
15 9 16 1
16 11 17 1
17 12 18 1
18 14 19 1
19 14 20 2
20 16 21 2
21 16 22 1
22 17 23 1
23 17 24 1 #Down
24 18 25 2
25 19 26 1
26 23 27 1
27 26 28 1
28 26 29 2
29 7 11 1
30 9 12 1
31 19 23 2
32 21 25 1
|
|---|
