Mol:FL2FAANI0020
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 |
| − | -1.7870 0.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7870 0.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7836 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7836 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0663 -0.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0663 -0.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3556 -0.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3556 -0.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3557 0.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3557 0.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 1.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 1.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3635 -0.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3635 -0.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0734 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0734 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0710 0.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0710 0.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3587 1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3587 1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7855 1.2387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7855 1.2387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4978 0.8302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4978 0.8302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2122 1.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2122 1.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2120 2.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2120 2.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4975 2.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4975 2.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7831 2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7831 2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3635 -1.2403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3635 -1.2403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5015 1.2303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5015 1.2303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 2.0595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 2.0595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0663 -1.2405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0663 -1.2405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9265 2.4804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9265 2.4804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4981 -0.4171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4981 -0.4171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2122 -1.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2122 -1.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4981 -1.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4981 -1.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2122 -2.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2122 -2.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9265 -1.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9265 -1.2428 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 |
| − | 6 19 1 0 0 0 0 | + | 6 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 2 22 1 0 0 0 0 | + | 2 22 1 0 0 0 0 |
| − | 23 24 2 0 0 0 0 | + | 23 24 2 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 23 26 1 0 0 0 0 | + | 23 26 1 0 0 0 0 |
| − | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL2FAANI0020 | + | ID FL2FAANI0020 |
| − | KNApSAcK_ID C00014158 | + | KNApSAcK_ID C00014158 |
| − | NAME 5,7,4'-Trihydroxy-8-methyl-6-prenylflavanone | + | NAME 5,7,4'-Trihydroxy-8-methyl-6-prenylflavanone |
| − | CAS_RN 261776-59-4 | + | CAS_RN 261776-59-4 |
| − | FORMULA C21H22O5 | + | FORMULA C21H22O5 |
| − | EXACTMASS 354.146723814 | + | EXACTMASS 354.146723814 |
| − | AVERAGEMASS 354.39638 | + | AVERAGEMASS 354.39638 |
| − | SMILES c(C(=O)2)(c3O)c(c(c(c(CC=C(C)C)3)O)C)OC(C2)c(c1)ccc(O)c1 | + | SMILES c(C(=O)2)(c3O)c(c(c(c(CC=C(C)C)3)O)C)OC(C2)c(c1)ccc(O)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/
26 28 0 0 0 0 0 0 0 0999 V2000
-1.7870 0.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7836 -0.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0663 -0.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3556 -0.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3557 0.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 1.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3635 -0.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0734 -0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0710 0.8262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3587 1.2347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7855 1.2387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4978 0.8302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2122 1.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2120 2.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4975 2.4802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7831 2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3635 -1.2403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5015 1.2303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 2.0595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0663 -1.2405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9265 2.4804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4981 -0.4171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2122 -1.6552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4981 -1.2429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2122 -2.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9265 -1.2428 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
6 19 1 0 0 0 0
3 20 1 0 0 0 0
14 21 1 0 0 0 0
2 22 1 0 0 0 0
23 24 2 0 0 0 0
23 25 1 0 0 0 0
23 26 1 0 0 0 0
22 24 1 0 0 0 0
S SKP 8
ID FL2FAANI0020
KNApSAcK_ID C00014158
NAME 5,7,4'-Trihydroxy-8-methyl-6-prenylflavanone
CAS_RN 261776-59-4
FORMULA C21H22O5
EXACTMASS 354.146723814
AVERAGEMASS 354.39638
SMILES c(C(=O)2)(c3O)c(c(c(c(CC=C(C)C)3)O)C)OC(C2)c(c1)ccc(O)c1
M END
