Mol:FLIAAANP0001
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 33 0 0 0 0 0 0 0 0999 V2000 | + | 30 33 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0117 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0117 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0117 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0117 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5112 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5112 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0108 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0108 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0108 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0108 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5112 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5112 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4897 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4897 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9901 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9901 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9901 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9901 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4897 0.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4897 0.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4897 -1.0008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4897 -1.0008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4902 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4902 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4902 -1.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4902 -1.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9544 -1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9544 -1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4185 -1.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4185 -1.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4185 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4185 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9544 -0.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9544 -0.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8817 -1.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8817 -1.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5112 -1.2072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5112 -1.2072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5118 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5118 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5112 1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5112 1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0117 1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0117 1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5121 1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5121 1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5121 0.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5121 0.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2418 0.9084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2418 0.9084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0829 1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0829 1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0144 -0.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0144 -0.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4763 -0.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4763 -0.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4763 -1.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4763 -1.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8817 -0.3720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8817 -0.3720 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 8 12 1 0 0 0 0 | + | 8 12 1 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 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 12 2 0 0 0 0 | + | 17 12 2 0 0 0 0 |
| − | 15 18 1 0 0 0 0 | + | 15 18 1 0 0 0 0 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 2 20 1 0 0 0 0 | + | 2 20 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 1 1 0 0 0 0 | + | 24 1 1 0 0 0 0 |
| − | 23 25 1 1 0 0 0 | + | 23 25 1 1 0 0 0 |
| − | 23 26 1 6 0 0 0 | + | 23 26 1 6 0 0 0 |
| − | 20 27 1 0 0 0 0 | + | 20 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 FLIAAANP0001 | + | ID FLIAAANP0001 |
| − | KNApSAcK_ID C00002555 | + | KNApSAcK_ID C00002555 |
| − | NAME Osajin | + | NAME Osajin |
| − | CAS_RN 482-53-1 | + | CAS_RN 482-53-1 |
| − | FORMULA C25H24O5 | + | FORMULA C25H24O5 |
| − | EXACTMASS 404.162373878 | + | EXACTMASS 404.162373878 |
| − | AVERAGEMASS 404.45506 | + | AVERAGEMASS 404.45506 |
| − | SMILES O(c14)C(C)(C)C=Cc(c(c(c(c(CC=C(C)C)4)O)2)OC=C(c(c3)ccc(c3)O)C2=O)1 | + | SMILES O(c14)C(C)(C)C=Cc(c(c(c(c(CC=C(C)C)4)O)2)OC=C(c(c3)ccc(c3)O)C2=O)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
30 33 0 0 0 0 0 0 0 0999 V2000
-1.0117 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0117 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5112 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0108 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0108 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5112 0.5260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4897 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9901 -0.3408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9901 0.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4897 0.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4897 -1.0008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4902 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4902 -1.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9544 -1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4185 -1.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4185 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9544 -0.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8817 -1.4329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5112 -1.2072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5118 -0.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5112 1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0117 1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5121 1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5121 0.5260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2418 0.9084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0829 1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0144 -0.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4763 -0.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4763 -1.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8817 -0.3720 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
7 11 2 0 0 0 0
8 12 1 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 17 1 0 0 0 0
17 12 2 0 0 0 0
15 18 1 0 0 0 0
3 19 1 0 0 0 0
2 20 1 0 0 0 0
6 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 1 1 0 0 0 0
23 25 1 1 0 0 0
23 26 1 6 0 0 0
20 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 FLIAAANP0001
KNApSAcK_ID C00002555
NAME Osajin
CAS_RN 482-53-1
FORMULA C25H24O5
EXACTMASS 404.162373878
AVERAGEMASS 404.45506
SMILES O(c14)C(C)(C)C=Cc(c(c(c(c(CC=C(C)C)4)O)2)OC=C(c(c3)ccc(c3)O)C2=O)1
M END
