Mol:FLIAAANI0007
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 30 32 0 0 0 0 0 0 0 0999 V2000 | + | 30 32 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.8761 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8761 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8761 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8761 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3198 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3198 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7635 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7635 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7635 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7635 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3198 2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3198 2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2072 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2072 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6509 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6509 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6509 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6509 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2072 2.1866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2072 2.1866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0948 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0948 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0948 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0948 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5000 -0.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5000 -0.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0947 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0947 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0947 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0947 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5000 1.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5000 1.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2072 0.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2072 0.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4322 2.1865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4322 2.1865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3198 0.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3198 0.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6889 -0.1279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6889 -0.1279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5000 -0.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5000 -0.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0942 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0942 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0942 -1.8435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0942 -1.8435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6884 -2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6884 -2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5000 -2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5000 -2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6889 1.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6889 1.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2712 0.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2712 0.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8523 1.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8523 1.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4322 0.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4322 0.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8523 1.9140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8523 1.9140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 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 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 8 11 1 0 0 0 0 | + | 8 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 15 26 1 0 0 0 0 | + | 15 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 2 0 0 0 0 | + | 27 28 2 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 28 30 1 0 0 0 0 | + | 28 30 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIAAANI0007 | + | ID FLIAAANI0007 |
| − | KNApSAcK_ID C00009882 | + | KNApSAcK_ID C00009882 |
| − | NAME 3',5'-Diprenylgenistein;5,7,4'-Trihydroxy-3',5'-diprenylisoflavone | + | NAME 3',5'-Diprenylgenistein;5,7,4'-Trihydroxy-3',5'-diprenylisoflavone |
| − | CAS_RN 104055-80-3 | + | CAS_RN 104055-80-3 |
| − | FORMULA C25H26O5 | + | FORMULA C25H26O5 |
| − | EXACTMASS 406.178023942 | + | EXACTMASS 406.178023942 |
| − | AVERAGEMASS 406.47094 | + | AVERAGEMASS 406.47094 |
| − | SMILES c(C(=C3)C(=O)c(c(O3)2)c(O)cc(O)c2)(c1)cc(c(O)c(CC=C(C)C)1)CC=C(C)C | + | SMILES c(C(=C3)C(=O)c(c(O3)2)c(O)cc(O)c2)(c1)cc(c(O)c(CC=C(C)C)1)CC=C(C)C |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
30 32 0 0 0 0 0 0 0 0999 V2000
-2.8761 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8761 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3198 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7635 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7635 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3198 2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2072 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6509 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6509 1.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2072 2.1866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0948 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0948 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5000 -0.1282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0947 0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0947 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5000 1.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2072 0.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4322 2.1865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3198 0.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6889 -0.1279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5000 -0.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0942 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0942 -1.8435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6884 -2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5000 -2.1866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6889 1.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2712 0.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8523 1.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4322 0.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8523 1.9140 0.0000 C 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
1 18 1 0 0 0 0
3 19 1 0 0 0 0
14 20 1 0 0 0 0
13 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
15 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
S SKP 8
ID FLIAAANI0007
KNApSAcK_ID C00009882
NAME 3',5'-Diprenylgenistein;5,7,4'-Trihydroxy-3',5'-diprenylisoflavone
CAS_RN 104055-80-3
FORMULA C25H26O5
EXACTMASS 406.178023942
AVERAGEMASS 406.47094
SMILES c(C(=C3)C(=O)c(c(O3)2)c(O)cc(O)c2)(c1)cc(c(O)c(CC=C(C)C)1)CC=C(C)C
M END
