Mol:FL2FA8NS0008
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 25 0 0 0 0 0 0 0 0999 V2000 | + | 23 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.8761 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8761 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8761 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8761 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1616 -1.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1616 -1.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4472 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4472 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4472 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4472 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1616 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1616 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2673 -1.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2673 -1.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9818 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9818 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9818 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9818 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2673 0.0187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2673 0.0187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7403 0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7403 0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4547 -0.3683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4547 -0.3683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1692 0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1692 0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1692 0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1692 0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4547 1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4547 1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7403 0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7403 0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2673 -2.3573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2673 -2.3573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1616 -2.3245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1616 -2.3245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5465 -0.0067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5465 -0.0067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4547 -1.0868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4547 -1.0868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1692 -0.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1692 -0.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4547 1.9822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4547 1.9822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1044 2.3573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1044 2.3573 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 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 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 |
| − | 9 11 1 0 0 0 0 | + | 9 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 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 12 20 1 0 0 0 0 | + | 12 20 1 0 0 0 0 |
| − | 19 21 1 0 0 0 0 | + | 19 21 1 0 0 0 0 |
| − | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA8NS0008 | + | ID FL2FA8NS0008 |
| − | KNApSAcK_ID C00014124 | + | KNApSAcK_ID C00014124 |
| − | NAME 5,2'-Dihydroxy-7,5'-dimethoxyflavanone | + | NAME 5,2'-Dihydroxy-7,5'-dimethoxyflavanone |
| − | CAS_RN 625111-94-6 | + | CAS_RN 625111-94-6 |
| − | FORMULA C17H16O6 | + | FORMULA C17H16O6 |
| − | EXACTMASS 316.094688244 | + | EXACTMASS 316.094688244 |
| − | AVERAGEMASS 316.30534 | + | AVERAGEMASS 316.30534 |
| − | SMILES COc(c3)cc(c(O)c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1 | + | SMILES COc(c3)cc(c(O)c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-1.8761 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8761 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1616 -1.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4472 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4472 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1616 0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2673 -1.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9818 -1.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9818 -0.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2673 0.0187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7403 0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4547 -0.3683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1692 0.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1692 0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4547 1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7403 0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2673 -2.3573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1616 -2.3245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5465 -0.0067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4547 -1.0868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1692 -0.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4547 1.9822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1044 2.3573 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
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 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
3 18 1 0 0 0 0
1 19 1 0 0 0 0
12 20 1 0 0 0 0
19 21 1 0 0 0 0
15 22 1 0 0 0 0
22 23 1 0 0 0 0
S SKP 8
ID FL2FA8NS0008
KNApSAcK_ID C00014124
NAME 5,2'-Dihydroxy-7,5'-dimethoxyflavanone
CAS_RN 625111-94-6
FORMULA C17H16O6
EXACTMASS 316.094688244
AVERAGEMASS 316.30534
SMILES COc(c3)cc(c(O)c3)C(C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1
M END
