Mol:FL1DRTNS0007
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 |
| − | -2.5095 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5095 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5095 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5095 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7950 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7950 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0806 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0806 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0806 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0806 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7950 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7950 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3206 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3206 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3778 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3778 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3206 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3206 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3778 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3778 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0938 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0938 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8083 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8083 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5228 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5228 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5228 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5228 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8083 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8083 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0938 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0938 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1552 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1552 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1552 1.7283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1552 1.7283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4623 1.7278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4623 1.7278 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 |
| − | 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 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 16 19 1 0 0 0 0 | + | 16 19 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL1DRTNS0007 | + | ID FL1DRTNS0007 |
| − | KNApSAcK_ID C00014596 | + | KNApSAcK_ID C00014596 |
| − | NAME 2,4,4'-Trihydroxydihydrochalcone | + | NAME 2,4,4'-Trihydroxydihydrochalcone |
| − | CAS_RN 15097-74-2 | + | CAS_RN 15097-74-2 |
| − | FORMULA C15H14O4 | + | FORMULA C15H14O4 |
| − | EXACTMASS 258.089208936 | + | EXACTMASS 258.089208936 |
| − | AVERAGEMASS 258.26926000000003 | + | AVERAGEMASS 258.26926000000003 |
| − | SMILES Oc(c2)ccc(c2)C(=O)CCc(c1)c(O)cc(O)c1 | + | SMILES Oc(c2)ccc(c2)C(=O)CCc(c1)c(O)cc(O)c1 |
M END | M END | ||
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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
-2.5095 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5095 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7950 -1.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0806 -0.6679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0806 0.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7950 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3206 -1.1067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3778 -0.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3206 -1.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3778 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0938 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8083 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5228 0.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5228 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8083 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0938 1.3632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1552 0.5299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1552 1.7283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4623 1.7278 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
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
1 17 1 0 0 0 0
14 18 1 0 0 0 0
16 19 1 0 0 0 0
S SKP 8
ID FL1DRTNS0007
KNApSAcK_ID C00014596
NAME 2,4,4'-Trihydroxydihydrochalcone
CAS_RN 15097-74-2
FORMULA C15H14O4
EXACTMASS 258.089208936
AVERAGEMASS 258.26926000000003
SMILES Oc(c2)ccc(c2)C(=O)CCc(c1)c(O)cc(O)c1
M END
