Molecule:100943: Difference between revisions
From ChemWiki
molecule
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|moleculeKey= | |moleculeKey= | ||
|molOrRxn= | |molOrRxn= | ||
ChemDraw04092515402D | |||
50 62 0 0 0 0 0 0 0 0999 V2000 | |||
-0.7145 1.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-0.7145 0.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.0000 0.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.7145 0.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.7145 1.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.0000 2.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.0000 -0.4388 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 | |||
-0.7969 -0.6523 0.0000 Co 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.7969 -0.6523 0.0000 Co 0 0 0 0 0 0 0 0 0 0 0 0 | |||
1.4289 0.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-1.4289 0.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.1434 0.7987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.1434 0.7987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.1434 1.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.8579 0.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.8579 2.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.8579 2.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-3.5724 3.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-4.2868 2.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-4.2868 2.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-3.5724 1.6237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.1434 1.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.8579 0.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.8579 2.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
3.5724 1.6237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | |||
4.2868 2.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
4.2868 2.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
3.5724 3.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.8579 2.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.0000 2.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.8579 -0.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.8579 -0.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-3.5724 -0.8513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-3.5724 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.8579 -2.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.1434 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-2.1434 -0.8513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.1434 -0.8513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.1434 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
2.8579 -2.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
3.5724 -1.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
3.5724 -0.8513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-0.0752 -1.4743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.6393 -1.8868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
1.3537 -1.4743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.6393 -2.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-1.2703 -2.0362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-0.5559 -2.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
0.1586 -2.0362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | |||
-0.5559 -3.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | |||
1 2 2 0 0 | |||
2 3 1 0 0 | |||
3 4 2 0 0 | |||
4 5 1 0 0 | |||
5 6 2 0 0 | |||
6 1 1 0 0 | |||
3 7 1 0 0 | |||
7 8 1 0 0 | |||
7 9 1 0 0 | |||
4 10 1 0 0 | |||
2 11 1 0 0 | |||
10 12 1 0 0 | |||
11 13 1 0 0 | |||
13 14 1 0 0 | |||
13 15 1 0 0 | |||
14 16 1 0 0 | |||
16 17 2 0 0 | |||
17 18 1 0 0 | |||
18 19 2 0 0 | |||
19 20 1 0 0 | |||
20 21 2 0 0 | |||
21 16 1 0 0 | |||
12 22 1 0 0 | |||
12 23 1 0 0 | |||
22 24 1 0 0 | |||
24 25 2 0 0 | |||
25 26 1 0 0 | |||
26 27 2 0 0 | |||
27 28 1 0 0 | |||
28 29 2 0 0 | |||
29 24 1 0 0 | |||
6 30 1 0 0 | |||
15 31 1 0 0 | |||
23 32 1 0 0 | |||
31 33 2 0 0 | |||
33 34 1 0 0 | |||
34 35 2 0 0 | |||
35 36 1 0 0 | |||
36 37 2 0 0 | |||
37 31 1 0 0 | |||
32 38 2 0 0 | |||
38 39 1 0 0 | |||
39 40 2 0 0 | |||
40 41 1 0 0 | |||
41 42 2 0 0 | |||
42 32 1 0 0 | |||
43 44 4 0 0 | |||
44 45 4 0 0 | |||
44 46 1 0 0 | |||
8 43 1 0 0 | |||
9 45 1 0 0 | |||
47 48 4 0 0 | |||
48 49 4 0 0 | |||
48 50 1 0 0 | |||
8 47 1 0 0 | |||
9 49 1 0 0 | |||
8 37 10 0 0 | |||
8 13 10 0 0 | |||
8 21 10 0 0 | |||
9 12 10 0 0 | |||
9 38 10 0 0 | |||
9 25 10 0 0 | |||
M CHG 1 7 1 | |||
M END | |||
|smiles= | |smiles= | ||
|inchi= | |inchi= | ||
Latest revision as of 14:41, 9 April 2025
| Properties | |
|---|---|
| CID | n/a |
| CAS | n/a |
| IUPAC-Name | n/a |
| Abbreviation | n/a |
| Trivialname | n/a |
| Exact mass | n/a |
| Molecular formula | n/a |
| LogP | n/a |
| Has vendors | n/a |
| Molecular role | n/a |
| Synonyms | n/a |
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