Mol:FL2FAANI0006
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 25 27 0 0 0 0 0 0 0 0999 V2000 | + | 25 27 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.8538 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8538 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8538 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8538 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2975 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2975 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2588 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2588 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2588 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2588 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2975 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2975 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8151 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8151 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3714 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3714 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3714 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3714 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8151 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8151 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9275 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9275 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4945 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4945 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0615 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0615 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0615 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0615 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4945 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4945 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9275 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9275 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8151 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8151 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2975 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2975 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4099 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4099 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6283 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6283 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9648 0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9648 0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5197 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5197 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0746 0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0746 0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6283 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6283 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0746 -0.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0746 -0.4874 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 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 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 19 21 1 0 0 0 0 | + | 19 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 2 0 0 0 0 | + | 22 23 2 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANI0006 | + | ID FL2FAANI0006 |
| − | KNApSAcK_ID C00008265 | + | KNApSAcK_ID C00008265 |
| − | NAME 5,4'-Dihydroxy-7-O-prenylflavanone | + | NAME 5,4'-Dihydroxy-7-O-prenylflavanone |
| − | CAS_RN 68236-14-6 | + | CAS_RN 68236-14-6 |
| − | FORMULA C20H20O5 | + | FORMULA C20H20O5 |
| − | EXACTMASS 340.13107375 | + | EXACTMASS 340.13107375 |
| − | AVERAGEMASS 340.3698 | + | AVERAGEMASS 340.3698 |
| − | SMILES Oc(c1)ccc(C(C2)Oc(c3)c(c(cc3OCC=C(C)C)O)C(=O)2)c1 | + | SMILES Oc(c1)ccc(C(C2)Oc(c3)c(c(cc3OCC=C(C)C)O)C(=O)2)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/
25 27 0 0 0 0 0 0 0 0999 V2000
-0.8538 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8538 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2975 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2588 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2588 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2975 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8151 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3714 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3714 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8151 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9275 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4945 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0615 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0615 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4945 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9275 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8151 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2975 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4099 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6283 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9648 0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5197 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0746 0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6283 0.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0746 -0.4874 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 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
14 20 1 0 0 0 0
19 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
S SKP 8
ID FL2FAANI0006
KNApSAcK_ID C00008265
NAME 5,4'-Dihydroxy-7-O-prenylflavanone
CAS_RN 68236-14-6
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES Oc(c1)ccc(C(C2)Oc(c3)c(c(cc3OCC=C(C)C)O)C(=O)2)c1
M END
