| Entry |
|
|---|
| Name |
trans-2-(4-Methoxyphenyl)-3-(4-nitrophenyl)oxirane;
trans-4-Methoxy-4'-nitrostilbene oxide
|
|---|
| Formula |
C15H13NO4
|
|---|
| Exact mass |
271.0845
|
|---|
| Mol weight |
271.268
|
|---|
| Structure |
|
|---|
| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1309 Diphenyl ethers, biphenyls, dibenzyls and stilbenes
C15457 trans-2-(4-Methoxyphenyl)-3-(4-nitrophenyl)oxirane
|
|---|
| Other DBs |
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|---|
| LinkDB |
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| KCF data |
ATOM 20
1 C1y C 16.0300 -15.0500
2 C1y C 17.4300 -15.0500
3 O2x O 16.7300 -13.8376
4 C8y C 14.8176 -15.7500
5 C8y C 18.6424 -15.7500
6 C8x C 13.6052 -15.0500
7 C8x C 12.3927 -15.7500
8 C8y C 12.3927 -17.1500
9 C8x C 13.6052 -17.8500
10 C8x C 14.8176 -17.1500
11 C8x C 18.6424 -17.1500
12 C8x C 19.8548 -17.8500
13 C8y C 21.0673 -17.1500
14 C8x C 21.0673 -15.7500
15 C8x C 19.8548 -15.0500
16 N2b N 22.2818 -17.8512 #+
17 O2a O 11.1782 -17.8512
18 C1a C 9.9817 -17.1602
19 O3a O 23.4783 -17.1602 #-
20 O3a O 22.2818 -19.2498
BOND 22
1 1 2 1
2 1 3 1
3 2 3 1
4 1 4 1 #Down
5 2 5 1 #Up
6 4 6 2
7 6 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 4 10 1
12 5 11 2
13 11 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 5 15 1
18 13 16 1
19 8 17 1
20 17 18 1
21 16 19 1
22 16 20 2
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