Mol:FL1DRTNS0006
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 |
| − | -2.8296 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8296 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8296 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8296 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1151 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1151 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4007 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4007 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4007 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4007 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1151 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1151 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6407 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6407 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0577 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0577 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6407 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6407 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0577 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0577 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7738 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7738 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4882 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4882 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2027 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2027 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2027 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2027 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4882 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4882 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7738 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7738 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8296 1.7251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8296 1.7251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1366 1.7310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1366 1.7310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4323 1.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4323 1.4026 0.0000 C 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 |
| − | 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 |
| − | 7 9 2 0 0 0 0 | + | 7 9 2 0 0 0 0 |
| − | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 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 |
| − | 14 17 1 0 0 0 0 | + | 14 17 1 0 0 0 0 |
| − | 16 18 1 0 0 0 0 | + | 16 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 FL1DRTNS0006 | + | ID FL1DRTNS0006 |
| − | KNApSAcK_ID C00014593 | + | KNApSAcK_ID C00014593 |
| − | NAME 2-Methoxy-4-hydroxydihydrochalcone | + | NAME 2-Methoxy-4-hydroxydihydrochalcone |
| − | CAS_RN 196863-37-3 | + | CAS_RN 196863-37-3 |
| − | FORMULA C16H16O3 | + | FORMULA C16H16O3 |
| − | EXACTMASS 256.109944378 | + | EXACTMASS 256.109944378 |
| − | AVERAGEMASS 256.29643999999996 | + | AVERAGEMASS 256.29643999999996 |
| − | SMILES COc(c2)c(ccc(O)2)CCC(=O)c(c1)cccc1 | + | SMILES COc(c2)c(ccc(O)2)CCC(=O)c(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
-2.8296 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8296 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1151 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4007 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4007 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1151 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6407 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0577 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6407 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0577 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7738 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4882 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2027 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2027 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4882 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7738 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8296 1.7251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1366 1.7310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4323 1.4026 0.0000 C 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
4 7 1 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
8 10 1 0 0 0 0
10 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
14 17 1 0 0 0 0
16 18 1 0 0 0 0
18 19 1 0 0 0 0
S SKP 8
ID FL1DRTNS0006
KNApSAcK_ID C00014593
NAME 2-Methoxy-4-hydroxydihydrochalcone
CAS_RN 196863-37-3
FORMULA C16H16O3
EXACTMASS 256.109944378
AVERAGEMASS 256.29643999999996
SMILES COc(c2)c(ccc(O)2)CCC(=O)c(c1)cccc1
M END
