Mol:FLIAAANI0004
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 |
| − | -1.4489 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4489 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4489 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4489 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8926 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8926 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3363 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3363 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3363 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3363 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8926 0.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8926 0.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2200 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2200 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7763 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7763 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7763 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7763 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2200 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2200 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3324 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3324 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3324 -1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3324 -1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9272 -1.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9272 -1.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5220 -1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5220 -1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5220 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5220 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9272 -0.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9272 -0.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2200 -1.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2200 -1.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8926 -1.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8926 -1.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0052 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0052 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1162 -1.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1162 -1.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0052 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0052 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0052 -1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0052 -1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5613 -1.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5613 -1.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5613 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5613 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1162 -1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1162 -1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8926 1.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8926 1.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3365 1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3365 1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3365 2.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3365 2.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2184 2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2184 2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8914 2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8914 2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 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 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 11 1 0 0 0 0 | + | 16 11 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 |
| − | 19 2 1 0 0 0 0 | + | 19 2 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 21 1 1 0 0 0 0 | + | 21 1 1 0 0 0 0 |
| − | 19 22 1 0 0 0 0 | + | 19 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 |
| − | 6 26 1 0 0 0 0 | + | 6 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 FLIAAANI0004 | + | ID FLIAAANI0004 |
| − | KNApSAcK_ID C00009516 | + | KNApSAcK_ID C00009516 |
| − | NAME 6,8-Diprenylgenistein | + | NAME 6,8-Diprenylgenistein |
| − | CAS_RN 51225-28-6 | + | CAS_RN 51225-28-6 |
| − | FORMULA C25H26O5 | + | FORMULA C25H26O5 |
| − | EXACTMASS 406.178023942 | + | EXACTMASS 406.178023942 |
| − | AVERAGEMASS 406.47094 | + | AVERAGEMASS 406.47094 |
| − | SMILES c(c(CC=C(C)C)3)(c(c(c(c3O)CC=C(C)C)1)C(C(c(c2)ccc(c2)O)=CO1)=O)O | + | SMILES c(c(CC=C(C)C)3)(c(c(c(c3O)CC=C(C)C)1)C(C(c(c2)ccc(c2)O)=CO1)=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/
30 32 0 0 0 0 0 0 0 0999 V2000
-1.4489 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4489 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8926 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3363 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3363 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8926 0.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2200 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7763 -0.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7763 0.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2200 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3324 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3324 -1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9272 -1.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5220 -1.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5220 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9272 -0.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2200 -1.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8926 -1.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0052 -0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1162 -1.8323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0052 0.4822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0052 -1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5613 -1.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5613 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1162 -1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8926 1.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3365 1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3365 2.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2184 2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8914 2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 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 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
3 18 1 0 0 0 0
19 2 1 0 0 0 0
14 20 1 0 0 0 0
21 1 1 0 0 0 0
19 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
6 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 FLIAAANI0004
KNApSAcK_ID C00009516
NAME 6,8-Diprenylgenistein
CAS_RN 51225-28-6
FORMULA C25H26O5
EXACTMASS 406.178023942
AVERAGEMASS 406.47094
SMILES c(c(CC=C(C)C)3)(c(c(c(c3O)CC=C(C)C)1)C(C(c(c2)ccc(c2)O)=CO1)=O)O
M END
