Mol:FLIA1ANP0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 24 27 0 0 0 0 0 0 0 0999 V2000 | + | 24 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.3111 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3111 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3111 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3111 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7548 0.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7548 0.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1985 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1985 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1985 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1985 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7548 1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7548 1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6422 0.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6422 0.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0858 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0858 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0858 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0858 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6422 1.8463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6422 1.8463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4702 0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4702 0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4702 -0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4702 -0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0650 -0.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0650 -0.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6598 -0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6598 -0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6598 0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6598 0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0650 0.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0650 0.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6422 -0.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6422 -0.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8672 1.8461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8672 1.8461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0650 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0650 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6598 -1.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6598 -1.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2546 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2546 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2546 -0.4685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2546 -0.4685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4397 -1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4397 -1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8672 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8672 -1.1553 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 14 1 0 0 0 0 | + | 22 14 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FLIA1ANP0001 | + | ID FLIA1ANP0001 |
| − | KNApSAcK_ID C00009430 | + | KNApSAcK_ID C00009430 |
| − | NAME Corylin | + | NAME Corylin |
| − | CAS_RN 53947-92-5 | + | CAS_RN 53947-92-5 |
| − | FORMULA C20H16O4 | + | FORMULA C20H16O4 |
| − | EXACTMASS 320.104859 | + | EXACTMASS 320.104859 |
| − | AVERAGEMASS 320.33864 | + | AVERAGEMASS 320.33864 |
| − | SMILES c(c12)(ccc(C(C3=O)=COc(c4)c(ccc(O)4)3)c2)OC(C=C1)(C)C | + | SMILES c(c12)(ccc(C(C3=O)=COc(c4)c(ccc(O)4)3)c2)OC(C=C1)(C)C |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
24 27 0 0 0 0 0 0 0 0999 V2000
-2.3111 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3111 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7548 0.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1985 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1985 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7548 1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6422 0.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0858 0.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0858 1.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6422 1.8463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4702 0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4702 -0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0650 -0.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6598 -0.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6598 0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0650 0.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6422 -0.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8672 1.8461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0650 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6598 -1.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2546 -1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2546 -0.4685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4397 -1.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8672 -1.1553 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
1 18 1 0 0 0 0
13 19 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 14 1 0 0 0 0
21 23 1 0 0 0 0
21 24 1 0 0 0 0
S SKP 8
ID FLIA1ANP0001
KNApSAcK_ID C00009430
NAME Corylin
CAS_RN 53947-92-5
FORMULA C20H16O4
EXACTMASS 320.104859
AVERAGEMASS 320.33864
SMILES c(c12)(ccc(C(C3=O)=COc(c4)c(ccc(O)4)3)c2)OC(C=C1)(C)C
M END
