Mol:FL1C19NS0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 20 0 0 0 0 0 0 0 0999 V2000 | + | 19 20 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.5065 1.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5065 1.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5065 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5065 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7921 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7921 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0776 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0776 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0776 1.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0776 1.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7921 1.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7921 1.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3631 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3631 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3513 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3513 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0655 -0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0655 -0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7797 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7797 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5002 -0.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5002 -0.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2207 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2207 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2207 1.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2207 1.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5002 1.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5002 1.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7797 1.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7797 1.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3631 -0.8552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3631 -0.8552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2207 1.4384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2207 1.4384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7921 -1.0364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7921 -1.0364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5065 -1.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5065 -1.4489 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 11 2 0 0 0 0 | + | 10 11 2 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 10 1 0 0 0 0 | + | 15 10 1 0 0 0 0 |
| − | 7 16 2 0 0 0 0 | + | 7 16 2 0 0 0 0 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1C19NS0002 | + | ID FL1C19NS0002 |
| − | KNApSAcK_ID C00006921 | + | KNApSAcK_ID C00006921 |
| − | NAME 4'-Hydroxy-2'-methoxychalcone | + | NAME 4'-Hydroxy-2'-methoxychalcone |
| − | CAS_RN 69470-84-4 | + | CAS_RN 69470-84-4 |
| − | FORMULA C16H14O3 | + | FORMULA C16H14O3 |
| − | EXACTMASS 254.094294314 | + | EXACTMASS 254.094294314 |
| − | AVERAGEMASS 254.28056 | + | AVERAGEMASS 254.28056 |
| − | SMILES COc(c2)c(ccc(O)2)C(=O)C=Cc(c1)cccc1 | + | SMILES COc(c2)c(ccc(O)2)C(=O)C=Cc(c1)cccc1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 20 0 0 0 0 0 0 0 0999 V2000
-2.5065 1.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5065 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7921 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0776 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0776 1.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7921 1.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3631 -0.2114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3513 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0655 -0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7797 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5002 -0.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2207 0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2207 1.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5002 1.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7797 1.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3631 -0.8552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2207 1.4384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7921 -1.0364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5065 -1.4489 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 11 2 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 10 1 0 0 0 0
7 16 2 0 0 0 0
1 17 1 0 0 0 0
3 18 1 0 0 0 0
18 19 1 0 0 0 0
S SKP 8
ID FL1C19NS0002
KNApSAcK_ID C00006921
NAME 4'-Hydroxy-2'-methoxychalcone
CAS_RN 69470-84-4
FORMULA C16H14O3
EXACTMASS 254.094294314
AVERAGEMASS 254.28056
SMILES COc(c2)c(ccc(O)2)C(=O)C=Cc(c1)cccc1
M END
