Mol:FL3FECNS0018
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 29 0 0 0 0 0 0 0 0999 V2000 | + | 25 29 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.0021 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0021 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0021 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0021 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4458 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4458 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8895 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8895 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8895 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8895 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4458 0.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4458 0.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3332 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3332 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2231 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2231 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2231 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2231 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3332 0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3332 0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3332 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3332 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7792 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7792 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3462 0.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3462 0.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9131 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9131 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9131 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9131 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3462 1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3462 1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7792 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7792 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5198 0.3365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5198 0.3365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8619 0.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8619 0.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4666 1.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4666 1.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4795 -0.8942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4795 -0.8942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2182 -1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2182 -1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5794 -1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5794 -1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0650 0.5481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0650 0.5481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8619 0.7617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8619 0.7617 0.0000 C 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 15 1 0 0 0 0 | + | 20 15 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 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 3 1 0 0 0 0 | + | 23 3 1 0 0 0 0 |
| − | 1 24 1 0 0 0 0 | + | 1 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 24 25 | + | M SAL 1 2 24 25 |
| − | M SBL 1 1 28 | + | M SBL 1 1 28 |
| − | M SMT 1 ^OCH3 | + | M SMT 1 ^OCH3 |
| − | M SBV 1 28 -6.6809 3.4769 | + | M SBV 1 28 -6.6809 3.4769 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FECNS0018 | + | ID FL3FECNS0018 |
| − | KNApSAcK_ID C00003998 | + | KNApSAcK_ID C00003998 |
| − | NAME 7-Methoxy-5,6:3',4'-bis(methylenedioxy)flavone | + | NAME 7-Methoxy-5,6:3',4'-bis(methylenedioxy)flavone |
| − | CAS_RN 97640-84-1 | + | CAS_RN 97640-84-1 |
| − | FORMULA C18H12O7 | + | FORMULA C18H12O7 |
| − | EXACTMASS 340.058302738 | + | EXACTMASS 340.058302738 |
| − | AVERAGEMASS 340.28368 | + | AVERAGEMASS 340.28368 |
| − | SMILES c(c2OC)c(O3)c(C(=O)C=C3c(c5)cc(c4c5)OCO4)c(c21)OCO1 | + | SMILES c(c2OC)c(O3)c(C(=O)C=C3c(c5)cc(c4c5)OCO4)c(c21)OCO1 |
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 29 0 0 0 0 0 0 0 0999 V2000
-2.0021 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0021 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4458 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8895 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8895 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4458 0.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3332 -0.7856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2231 -0.4644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2231 0.1780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3332 0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3332 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7792 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3462 0.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9131 0.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9131 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3462 1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7792 1.1537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5198 0.3365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8619 0.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4666 1.3513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4795 -0.8942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2182 -1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5794 -1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0650 0.5481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8619 0.7617 0.0000 C 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
14 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 15 1 0 0 0 0
2 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 3 1 0 0 0 0
1 24 1 0 0 0 0
24 25 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 24 25
M SBL 1 1 28
M SMT 1 ^OCH3
M SBV 1 28 -6.6809 3.4769
S SKP 8
ID FL3FECNS0018
KNApSAcK_ID C00003998
NAME 7-Methoxy-5,6:3',4'-bis(methylenedioxy)flavone
CAS_RN 97640-84-1
FORMULA C18H12O7
EXACTMASS 340.058302738
AVERAGEMASS 340.28368
SMILES c(c2OC)c(O3)c(C(=O)C=C3c(c5)cc(c4c5)OCO4)c(c21)OCO1
M END
