Mol:FL2FADNI0006
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 27 29 0 0 0 0 0 0 0 0999 V2000 | + | 27 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.0420 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0420 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0235 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0235 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2463 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2463 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5915 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5915 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5773 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5773 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3030 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3030 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1635 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1635 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8373 -0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8373 -0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8280 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8280 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1442 0.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1442 0.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5425 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5425 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2336 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2336 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9450 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9450 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9654 1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9654 1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2537 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2537 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5333 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5333 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1635 -1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1635 -1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7565 0.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7565 0.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2463 -1.8609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2463 -1.8609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6672 1.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6672 1.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7176 -1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7176 -1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3931 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3931 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1653 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1653 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0114 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0114 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4032 -1.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4032 -1.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5338 0.2911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5338 0.2911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1653 0.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1653 0.6558 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 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 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FADNI0006 | + | ID FL2FADNI0006 |
| − | KNApSAcK_ID C00014182 | + | KNApSAcK_ID C00014182 |
| − | NAME (2S)-5,7,4'-Trihydroxy-3'-methoxy-6-(1,1-dimethylallyl)flavanone | + | NAME (2S)-5,7,4'-Trihydroxy-3'-methoxy-6-(1,1-dimethylallyl)flavanone |
| − | CAS_RN 192572-95-5 | + | CAS_RN 192572-95-5 |
| − | FORMULA C21H22O6 | + | FORMULA C21H22O6 |
| − | EXACTMASS 370.141638436 | + | EXACTMASS 370.141638436 |
| − | AVERAGEMASS 370.39578 | + | AVERAGEMASS 370.39578 |
| − | SMILES c(c1)(C(C3)Oc(c2)c(C(=O)3)c(O)c(c(O)2)C(C)(C)C=C)cc(c(O)c1)OC | + | SMILES c(c1)(C(C3)Oc(c2)c(C(=O)3)c(O)c(c(O)2)C(C)(C)C=C)cc(c(O)c1)OC |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
27 29 0 0 0 0 0 0 0 0999 V2000
-2.0420 0.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0235 -0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2463 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5915 -0.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5773 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3030 0.6147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1635 -1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8373 -0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8280 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1442 0.5898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5425 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2336 0.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9450 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9654 1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2537 1.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5333 1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1635 -1.8857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7565 0.5652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2463 -1.8609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6672 1.8611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7176 -1.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3931 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1653 -1.1076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0114 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4032 -1.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5338 0.2911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1653 0.6558 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 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
26 27 1 0 0 0 0
S SKP 8
ID FL2FADNI0006
KNApSAcK_ID C00014182
NAME (2S)-5,7,4'-Trihydroxy-3'-methoxy-6-(1,1-dimethylallyl)flavanone
CAS_RN 192572-95-5
FORMULA C21H22O6
EXACTMASS 370.141638436
AVERAGEMASS 370.39578
SMILES c(c1)(C(C3)Oc(c2)c(C(=O)3)c(O)c(c(O)2)C(C)(C)C=C)cc(c(O)c1)OC
M END
