Mol:FLIAAANI0012
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 35 37 0 0 0 0 0 0 0 0999 V2000 | + | 35 37 0 0 0 0 0 0 0 0999 V2000 |
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| − | -2.3735 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3735 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8172 -0.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8172 -0.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2609 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2609 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -0.1483 0.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1483 0.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 0.4078 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4078 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 1.5974 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5974 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0026 -0.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0026 -0.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -1.8172 -1.4466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8172 -1.4466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9296 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9296 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9296 -1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9296 -1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4845 -1.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4845 -1.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4845 -2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4845 -2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0394 -1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0394 -1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8172 1.1226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8172 1.1226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 2.1869 -1.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1869 -1.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -2.9284 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9284 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8186 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8186 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
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| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 11 2 0 0 0 0 | + | 16 11 2 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 6 24 1 0 0 0 0 | + | 6 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 26 14 1 0 0 0 0 | + | 26 14 1 0 0 0 0 |
| − | 25 27 2 0 0 0 0 | + | 25 27 2 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | 15 30 1 0 0 0 0 | + | 15 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 1 0 0 0 0 |
| − | 31 32 2 0 0 0 0 | + | 31 32 2 0 0 0 0 |
| − | 1 35 1 0 0 0 0 | + | 1 35 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAAANI0012 | + | ID FLIAAANI0012 |
| − | KNApSAcK_ID C00009951 | + | KNApSAcK_ID C00009951 |
| − | NAME Euchrenone b1;5,7,4'-Trihydroxy-6,8,3'-triprenylisoflavone | + | NAME Euchrenone b1;5,7,4'-Trihydroxy-6,8,3'-triprenylisoflavone |
| − | CAS_RN 119061-09-5 | + | CAS_RN 119061-09-5 |
| − | FORMULA C30H34O5 | + | FORMULA C30H34O5 |
| − | EXACTMASS 474.240624198 | + | EXACTMASS 474.240624198 |
| − | AVERAGEMASS 474.58796000000007 | + | AVERAGEMASS 474.58796000000007 |
| − | SMILES Oc(c12)c(CC=C(C)C)c(c(CC=C(C)C)c1OC=C(c(c3)ccc(c(CC=C(C)C)3)O)C2=O)O | + | SMILES Oc(c12)c(CC=C(C)C)c(c(CC=C(C)C)c1OC=C(c(c3)ccc(c(CC=C(C)C)3)O)C2=O)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
35 37 0 0 0 0 0 0 0 0999 V2000
-2.3735 0.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3735 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8172 -0.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2609 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2609 0.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8172 0.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7046 -0.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1483 -0.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1483 0.1590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7046 0.4802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4078 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4078 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0026 -1.8346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5974 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5974 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0026 -0.4610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7046 -1.4499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8172 -1.4466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9296 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9296 -1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4845 -1.7655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4845 -2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0394 -1.4451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8172 1.1226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3735 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1869 -1.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3735 2.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9284 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8186 2.4063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1916 -0.4613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7858 -0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4257 -0.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4257 0.2415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0394 -0.8215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8035 0.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
8 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 11 2 0 0 0 0
1 2 1 0 0 0 0
7 17 2 0 0 0 0
3 18 1 0 0 0 0
2 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
6 24 1 0 0 0 0
24 25 1 0 0 0 0
26 14 1 0 0 0 0
25 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
15 30 1 0 0 0 0
30 31 1 0 0 0 0
32 33 1 0 0 0 0
32 34 1 0 0 0 0
31 32 2 0 0 0 0
1 35 1 0 0 0 0
S SKP 8
ID FLIAAANI0012
KNApSAcK_ID C00009951
NAME Euchrenone b1;5,7,4'-Trihydroxy-6,8,3'-triprenylisoflavone
CAS_RN 119061-09-5
FORMULA C30H34O5
EXACTMASS 474.240624198
AVERAGEMASS 474.58796000000007
SMILES Oc(c12)c(CC=C(C)C)c(c(CC=C(C)C)c1OC=C(c(c3)ccc(c(CC=C(C)C)3)O)C2=O)O
M END
