Mol:FL2FACNI0014
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 26 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.7930 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7930 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7744 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7744 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9973 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9973 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3424 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3424 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3282 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3282 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0539 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0539 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4125 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4125 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0863 -0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0863 -0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0771 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0771 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3932 0.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3932 0.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7916 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7916 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4827 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4827 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1940 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1940 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2145 1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2145 1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5027 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5027 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7823 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7823 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4125 -1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4125 -1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5075 0.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5075 0.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9973 -1.8609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9973 -1.8609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9163 1.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9163 1.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4685 -1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4685 -1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1441 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1441 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9163 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9163 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7624 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7624 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1541 -1.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1541 -1.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7828 0.2911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7828 0.2911 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 |
| − | 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 6 0 0 0 | + | 9 11 1 6 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 |
| − | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
| − | 14 20 1 0 0 0 0 | + | 14 20 1 0 0 0 0 |
| − | 2 21 1 0 0 0 0 | + | 2 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 |
| − | 21 24 1 0 0 0 0 | + | 21 24 1 0 0 0 0 |
| − | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
| − | 13 26 1 0 0 0 0 | + | 13 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FACNI0014 | + | ID FL2FACNI0014 |
| − | KNApSAcK_ID C00014181 | + | KNApSAcK_ID C00014181 |
| − | NAME (2S)-5,7,3',4'-Tetrahydroxy-6-(1,1-dimethylallyl)flavanone | + | NAME (2S)-5,7,3',4'-Tetrahydroxy-6-(1,1-dimethylallyl)flavanone |
| − | CAS_RN 192572-94-4 | + | CAS_RN 192572-94-4 |
| − | FORMULA C20H20O6 | + | FORMULA C20H20O6 |
| − | EXACTMASS 356.125988372 | + | EXACTMASS 356.125988372 |
| − | AVERAGEMASS 356.3692 | + | AVERAGEMASS 356.3692 |
| − | SMILES C=CC(C)(C)c(c(O)3)c(O)c(C(=O)2)c(c3)OC(C2)c(c1)cc(c(O)c1)O | + | SMILES C=CC(C)(C)c(c(O)3)c(O)c(C(=O)2)c(c3)OC(C2)c(c1)cc(c(O)c1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
26 28 0 0 0 0 0 0 0 0999 V2000
-1.7930 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7744 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9973 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3424 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3282 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0539 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4125 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0863 -0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0771 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3932 0.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7916 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4827 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1940 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2145 1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5027 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7823 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4125 -1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5075 0.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9973 -1.8609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9163 1.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4685 -1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1441 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9163 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7624 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1541 -1.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7828 0.2911 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
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 6 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
3 19 1 0 0 0 0
14 20 1 0 0 0 0
2 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
21 24 1 0 0 0 0
21 25 1 0 0 0 0
13 26 1 0 0 0 0
S SKP 8
ID FL2FACNI0014
KNApSAcK_ID C00014181
NAME (2S)-5,7,3',4'-Tetrahydroxy-6-(1,1-dimethylallyl)flavanone
CAS_RN 192572-94-4
FORMULA C20H20O6
EXACTMASS 356.125988372
AVERAGEMASS 356.3692
SMILES C=CC(C)(C)c(c(O)3)c(O)c(C(=O)2)c(c3)OC(C2)c(c1)cc(c(O)c1)O
M END
