Mol:FL3FA9NF0002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 22 25 0 0 0 0 0 0 0 0999 V2000 | + | 22 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.4369 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4369 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4369 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4369 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1514 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1514 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8659 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8659 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8659 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8659 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1514 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1514 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2775 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2775 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9920 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9920 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9920 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9920 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2775 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2775 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7065 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7065 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4209 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4209 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1354 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1354 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1354 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1354 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4209 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4209 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7065 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7065 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2775 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2775 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1514 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1514 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6505 0.6674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6505 0.6674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1354 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1354 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6505 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6505 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4369 -2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4369 -2.0625 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 |
| − | 1 7 1 0 0 0 0 | + | 1 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 2 1 0 0 0 0 | + | 10 2 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 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 |
| − | 18 6 1 0 0 0 0 | + | 18 6 1 0 0 0 0 |
| − | 4 19 1 0 0 0 0 | + | 4 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 20 21 2 0 0 0 0 | + | 20 21 2 0 0 0 0 |
| − | 21 5 1 0 0 0 0 | + | 21 5 1 0 0 0 0 |
| − | 18 22 1 0 0 0 0 | + | 18 22 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FA9NF0002 | + | ID FL3FA9NF0002 |
| − | KNApSAcK_ID C00013444 | + | KNApSAcK_ID C00013444 |
| − | NAME Pinnatin;4-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one | + | NAME Pinnatin;4-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one |
| − | CAS_RN 1232-43-5 | + | CAS_RN 1232-43-5 |
| − | FORMULA C18H12O4 | + | FORMULA C18H12O4 |
| − | EXACTMASS 292.073558872 | + | EXACTMASS 292.073558872 |
| − | AVERAGEMASS 292.28548 | + | AVERAGEMASS 292.28548 |
| − | SMILES O(C=3c(c4)cccc4)c(c2)c(C(=O)C3)c(c(c21)cco1)OC | + | SMILES O(C=3c(c4)cccc4)c(c2)c(C(=O)C3)c(c(c21)cco1)OC |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
22 25 0 0 0 0 0 0 0 0999 V2000
-0.4369 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4369 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1514 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8659 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8659 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1514 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2775 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9920 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9920 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2775 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7065 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4209 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1354 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1354 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4209 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7065 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2775 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1514 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6505 0.6674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1354 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6505 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4369 -2.0625 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
1 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 2 1 0 0 0 0
9 11 1 0 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
18 6 1 0 0 0 0
4 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 5 1 0 0 0 0
18 22 1 0 0 0 0
S SKP 8
ID FL3FA9NF0002
KNApSAcK_ID C00013444
NAME Pinnatin;4-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one
CAS_RN 1232-43-5
FORMULA C18H12O4
EXACTMASS 292.073558872
AVERAGEMASS 292.28548
SMILES O(C=3c(c4)cccc4)c(c2)c(C(=O)C3)c(c(c21)cco1)OC
M END
