Mol:FL2FALNI0010
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 36 38 0 0 0 0 0 0 0 0999 V2000 | + | 36 38 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0639 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0639 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5431 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5431 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0222 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0222 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0222 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0222 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5431 -0.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5431 -0.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0639 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0639 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4987 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4987 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0196 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0196 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0196 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0196 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4987 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4987 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5400 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5400 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4987 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4987 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0743 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0743 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6087 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6087 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6087 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6087 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0743 0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0743 0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5400 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5400 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5431 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5431 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1430 0.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1430 0.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5431 0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5431 0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0634 0.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0634 0.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5843 -1.6863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5843 -1.6863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1047 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1047 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0634 1.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0634 1.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5838 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5838 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5431 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5431 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0743 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0743 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6239 -1.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6239 -1.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1430 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1430 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6239 -2.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6239 -2.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0065 0.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0065 0.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6078 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6078 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6078 1.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6078 1.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0755 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0755 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1401 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1401 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5843 -0.4840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5843 -0.4840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 3 7 1 0 0 0 0 | + | 3 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 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 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 2 18 1 0 0 0 0 | + | 2 18 1 0 0 0 0 |
| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 1 22 1 0 0 0 0 | + | 1 22 1 0 0 0 0 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 21 24 2 0 0 0 0 | + | 21 24 2 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 24 26 1 0 0 0 0 | + | 24 26 1 0 0 0 0 |
| − | 16 27 1 0 0 0 0 | + | 16 27 1 0 0 0 0 |
| − | 23 28 1 0 0 0 0 | + | 23 28 1 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 |
| − | 17 31 1 0 0 0 0 | + | 17 31 1 0 0 0 0 |
| − | 27 32 1 0 0 0 0 | + | 27 32 1 0 0 0 0 |
| − | 32 33 2 0 0 0 0 | + | 32 33 2 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 33 35 1 0 0 0 0 | + | 33 35 1 0 0 0 0 |
| − | 6 36 1 0 0 0 0 | + | 6 36 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FALNI0010 | + | ID FL2FALNI0010 |
| − | KNApSAcK_ID C00008477 | + | KNApSAcK_ID C00008477 |
| − | NAME Lespedezaflavanone E | + | NAME Lespedezaflavanone E |
| − | CAS_RN 133538-69-9 | + | CAS_RN 133538-69-9 |
| − | FORMULA C30H36O6 | + | FORMULA C30H36O6 |
| − | EXACTMASS 492.251188884 | + | EXACTMASS 492.251188884 |
| − | AVERAGEMASS 492.60324 | + | AVERAGEMASS 492.60324 |
| − | SMILES C(=C(C)C)Cc(c1O)c(O)ccc1C(O3)CC(c(c32)c(c(C=CC(C)C)c(O)c2CC=C(C)C)O)=O | + | SMILES C(=C(C)C)Cc(c1O)c(O)ccc1C(O3)CC(c(c32)c(c(C=CC(C)C)c(O)c2CC=C(C)C)O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
36 38 0 0 0 0 0 0 0 0999 V2000
-1.0639 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5431 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0222 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0222 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5431 -0.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0639 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4987 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0196 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0196 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4987 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5400 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4987 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0743 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6087 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6087 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0743 0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5400 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5431 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1430 0.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5431 0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0634 0.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5843 -1.6863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1047 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0634 1.0185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5838 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5431 1.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0743 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6239 -1.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1430 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6239 -2.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0065 0.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6078 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6078 1.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0755 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1401 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5843 -0.4840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
3 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 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 17 2 0 0 0 0
17 11 1 0 0 0 0
2 18 1 0 0 0 0
19 15 1 0 0 0 0
5 20 1 0 0 0 0
20 21 1 0 0 0 0
1 22 1 0 0 0 0
22 23 2 0 0 0 0
21 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
16 27 1 0 0 0 0
23 28 1 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
17 31 1 0 0 0 0
27 32 1 0 0 0 0
32 33 2 0 0 0 0
33 34 1 0 0 0 0
33 35 1 0 0 0 0
6 36 1 0 0 0 0
S SKP 8
ID FL2FALNI0010
KNApSAcK_ID C00008477
NAME Lespedezaflavanone E
CAS_RN 133538-69-9
FORMULA C30H36O6
EXACTMASS 492.251188884
AVERAGEMASS 492.60324
SMILES C(=C(C)C)Cc(c1O)c(O)ccc1C(O3)CC(c(c32)c(c(C=CC(C)C)c(O)c2CC=C(C)C)O)=O
M END
