Mol:FL3F1CNP0001
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 30 0 0 0 0 0 0 0 0999 V2000 | + | 26 30 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.8717 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8717 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8717 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8717 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3154 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3154 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7591 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7591 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7591 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7591 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3154 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3154 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2028 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2028 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3535 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3535 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3535 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3535 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2028 0.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2028 0.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2028 -1.5564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2028 -1.5564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9096 0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9096 0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4765 -0.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4765 -0.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0435 0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0435 0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0435 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0435 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4765 1.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4765 1.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9096 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9096 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3154 0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3154 0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8717 1.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8717 1.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4280 0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4280 0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4280 0.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4280 0.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0510 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0510 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8234 1.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8234 1.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6662 0.0268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6662 0.0268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0510 0.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0510 0.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6662 1.0861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6662 1.0861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 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 2 0 0 0 0 | + | 8 9 2 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 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 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 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 6 18 1 0 0 0 0 | + | 6 18 1 0 0 0 0 |
| − | 18 19 2 0 0 0 0 | + | 18 19 2 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 1 1 0 0 0 0 | + | 21 1 1 0 0 0 0 |
| − | 20 22 1 0 0 0 0 | + | 20 22 1 0 0 0 0 |
| − | 20 23 1 0 0 0 0 | + | 20 23 1 0 0 0 0 |
| − | 14 24 1 0 0 0 0 | + | 14 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 15 1 0 0 0 0 | + | 26 15 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3F1CNP0001 | + | ID FL3F1CNP0001 |
| − | KNApSAcK_ID C00004042 | + | KNApSAcK_ID C00004042 |
| − | NAME 6'',6''-Dimethyl-3',4'-methylenedioxypyrano[2'',3'':7,8]flavone | + | NAME 6'',6''-Dimethyl-3',4'-methylenedioxypyrano[2'',3'':7,8]flavone |
| − | CAS_RN 64316-98-9 | + | CAS_RN 64316-98-9 |
| − | FORMULA C21H16O5 | + | FORMULA C21H16O5 |
| − | EXACTMASS 348.099773622 | + | EXACTMASS 348.099773622 |
| − | AVERAGEMASS 348.34874 | + | AVERAGEMASS 348.34874 |
| − | SMILES O(C1)c(c2)c(ccc(C(=C5)Oc(c4C(=O)5)c(c(cc4)3)C=CC(C)(C)O3)2)O1 | + | SMILES O(C1)c(c2)c(ccc(C(=C5)Oc(c4C(=O)5)c(c(cc4)3)C=CC(C)(C)O3)2)O1 |
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 30 0 0 0 0 0 0 0 0999 V2000
-1.8717 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8717 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3154 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7591 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7591 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3154 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2028 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3535 -0.7343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3535 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2028 0.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2028 -1.5564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9096 0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4765 -0.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0435 0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0435 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4765 1.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9096 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3154 0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8717 1.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4280 0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4280 0.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0510 0.7047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8234 1.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6662 0.0268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0510 0.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6662 1.0861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 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 12 1 0 0 0 0
6 18 1 0 0 0 0
18 19 2 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
21 1 1 0 0 0 0
20 22 1 0 0 0 0
20 23 1 0 0 0 0
14 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 15 1 0 0 0 0
S SKP 8
ID FL3F1CNP0001
KNApSAcK_ID C00004042
NAME 6'',6''-Dimethyl-3',4'-methylenedioxypyrano[2'',3'':7,8]flavone
CAS_RN 64316-98-9
FORMULA C21H16O5
EXACTMASS 348.099773622
AVERAGEMASS 348.34874
SMILES O(C1)c(c2)c(ccc(C(=C5)Oc(c4C(=O)5)c(c(cc4)3)C=CC(C)(C)O3)2)O1
M END
