Mol:FL2FA8NS0011
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 |
| − | -1.8627 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8627 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8627 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8627 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1483 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1483 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4338 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4338 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4338 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4338 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1483 0.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1483 0.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2807 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2807 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9952 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9952 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9952 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9952 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2807 0.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2807 0.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7537 0.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7537 0.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4681 -0.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4681 -0.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1826 0.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1826 0.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1826 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1826 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4681 1.5079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4681 1.5079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7537 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7537 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2807 -2.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2807 -2.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5331 0.2195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5331 0.2195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1826 -0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1826 -0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1483 -2.1318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1483 -2.1318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4681 -0.8110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4681 -0.8110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9268 -1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9268 -1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4681 2.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4681 2.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0171 2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0171 2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7170 -2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7170 -2.4601 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 12 21 1 0 0 0 0 | + | 12 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 15 23 1 0 0 0 0 | + | 15 23 1 0 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 20 25 1 0 0 0 0 | + | 20 25 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FA8NS0011 | + | ID FL2FA8NS0011 |
| − | KNApSAcK_ID C00014130 | + | KNApSAcK_ID C00014130 |
| − | NAME 5,7,2',5'-Tetramethoxyflavanone | + | NAME 5,7,2',5'-Tetramethoxyflavanone |
| − | CAS_RN 85486-95-9 | + | CAS_RN 85486-95-9 |
| − | FORMULA C19H20O6 | + | FORMULA C19H20O6 |
| − | EXACTMASS 344.125988372 | + | EXACTMASS 344.125988372 |
| − | AVERAGEMASS 344.3585 | + | AVERAGEMASS 344.3585 |
| − | SMILES c(c(C(O2)CC(c(c(OC)3)c2cc(OC)c3)=O)1)(OC)ccc(OC)c1 | + | SMILES c(c(C(O2)CC(c(c(OC)3)c2cc(OC)c3)=O)1)(OC)ccc(OC)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
-1.8627 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8627 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1483 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4338 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4338 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1483 0.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2807 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9952 -0.9925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9952 -0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2807 0.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7537 0.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4681 -0.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1826 0.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1826 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4681 1.5079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7537 1.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2807 -2.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5331 0.2195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1826 -0.1554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1483 -2.1318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4681 -0.8110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9268 -1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4681 2.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0171 2.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7170 -2.4601 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
1 18 1 0 0 0 0
18 19 1 0 0 0 0
3 20 1 0 0 0 0
12 21 1 0 0 0 0
21 22 1 0 0 0 0
15 23 1 0 0 0 0
23 24 1 0 0 0 0
20 25 1 0 0 0 0
S SKP 8
ID FL2FA8NS0011
KNApSAcK_ID C00014130
NAME 5,7,2',5'-Tetramethoxyflavanone
CAS_RN 85486-95-9
FORMULA C19H20O6
EXACTMASS 344.125988372
AVERAGEMASS 344.3585
SMILES c(c(C(O2)CC(c(c(OC)3)c2cc(OC)c3)=O)1)(OC)ccc(OC)c1
M END
