Mol:FL2FAANI0014
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 |
| − | -1.8426 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8426 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3217 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3217 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8008 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8008 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8008 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8008 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3217 -0.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3217 -0.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8426 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8426 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2800 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2800 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2409 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2409 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2409 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2409 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2800 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2800 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7613 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7613 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2800 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2800 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2957 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2957 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8300 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8300 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8300 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8300 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2957 0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2957 0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7613 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7613 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3635 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3635 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3217 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3217 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3635 0.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3635 0.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2957 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2957 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8291 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8291 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8291 1.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8291 1.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2968 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2968 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3614 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3614 2.2875 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 |
| − | 3 7 1 0 0 0 0 | + | 3 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 4 1 0 0 0 0 | + | 10 4 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 7 12 2 0 0 0 0 | + | 7 12 2 0 0 0 0 |
| − | 11 13 2 0 0 0 0 | + | 11 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 11 1 0 0 0 0 | + | 17 11 1 0 0 0 0 |
| − | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 19 1 0 0 0 0 |
| − | 15 20 1 0 0 0 0 | + | 15 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 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 FL2FAANI0014 | + | ID FL2FAANI0014 |
| − | KNApSAcK_ID C00008451 | + | KNApSAcK_ID C00008451 |
| − | NAME Licoflavanone | + | NAME Licoflavanone |
| − | CAS_RN 119240-82-3 | + | CAS_RN 119240-82-3 |
| − | FORMULA C20H20O5 | + | FORMULA C20H20O5 |
| − | EXACTMASS 340.13107375 | + | EXACTMASS 340.13107375 |
| − | AVERAGEMASS 340.3698 | + | AVERAGEMASS 340.3698 |
| − | SMILES c(c1)(C(C2)Oc(c3)c(c(cc(O)3)O)C(=O)2)cc(c(O)c1)CC=C(C)C | + | SMILES c(c1)(C(C2)Oc(c3)c(c(cc(O)3)O)C(=O)2)cc(c(O)c1)CC=C(C)C |
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
-1.8426 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3217 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8008 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8008 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3217 -0.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8426 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2409 -1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2409 -0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7613 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -2.2105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2957 -0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8300 -0.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8300 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2957 0.4416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7613 0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3635 -0.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3217 -2.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3635 0.4410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2957 1.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8291 1.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8291 1.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2968 2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3614 2.2875 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
3 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 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 11 1 0 0 0 0
6 18 1 0 0 0 0
2 19 1 0 0 0 0
15 20 1 0 0 0 0
16 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 FL2FAANI0014
KNApSAcK_ID C00008451
NAME Licoflavanone
CAS_RN 119240-82-3
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES c(c1)(C(C2)Oc(c3)c(c(cc(O)3)O)C(=O)2)cc(c(O)c1)CC=C(C)C
M END
