Mol:FL5F19NF0002
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 |
| − | -0.4188 -0.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4188 -0.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4284 0.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4284 0.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2712 -1.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2712 -1.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9972 -0.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9972 -0.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0064 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0064 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2812 0.6237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2812 0.6237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7209 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7209 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1192 0.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1192 0.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8474 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8474 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8451 -0.6431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8451 -0.6431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1436 -1.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1436 -1.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2712 -1.8519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2712 -1.8519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7117 -1.0408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7117 -1.0408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4354 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4354 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1498 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1498 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1498 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1498 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4354 1.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4354 1.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7209 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7209 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7117 -1.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7117 -1.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6538 0.4636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6538 0.4636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1498 -0.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1498 -0.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6538 -0.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6538 -0.9070 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 |
| − | 1 3 1 0 0 0 0 | + | 1 3 1 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 2 1 0 0 0 0 | + | 6 2 1 0 0 0 0 |
| − | 7 5 1 0 0 0 0 | + | 7 5 1 0 0 0 0 |
| − | 2 8 2 0 0 0 0 | + | 2 8 2 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 1 2 0 0 0 0 | + | 11 1 2 0 0 0 0 |
| − | 3 12 2 0 0 0 0 | + | 3 12 2 0 0 0 0 |
| − | 4 13 1 0 0 0 0 | + | 4 13 1 0 0 0 0 |
| − | 7 14 2 0 0 0 0 | + | 7 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 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 18 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 18 7 1 0 0 0 0 | + | 18 7 1 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 9 20 1 0 0 0 0 | + | 9 20 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
| − | 22 10 1 0 0 0 0 | + | 22 10 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5F19NF0002 | + | ID FL5F19NF0002 |
| − | KNApSAcK_ID C00013534 | + | KNApSAcK_ID C00013534 |
| − | NAME Ponganone XI;6-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one | + | NAME Ponganone XI;6-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one |
| − | CAS_RN 142608-97-7 | + | CAS_RN 142608-97-7 |
| − | FORMULA C18H12O4 | + | FORMULA C18H12O4 |
| − | EXACTMASS 292.073558872 | + | EXACTMASS 292.073558872 |
| − | AVERAGEMASS 292.28548 | + | AVERAGEMASS 292.28548 |
| − | SMILES c(c12)c(C3=O)c(OC(c(c4)cccc4)=C3OC)cc1occ2 | + | SMILES c(c12)c(C3=O)c(OC(c(c4)cccc4)=C3OC)cc1occ2 |
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
-0.4188 -0.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4284 0.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2712 -1.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9972 -0.6283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0064 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2812 0.6237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7209 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1192 0.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8474 0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8451 -0.6431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1436 -1.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2712 -1.8519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7117 -1.0408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4354 0.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1498 0.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1498 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4354 1.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7209 1.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7117 -1.8598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6538 0.4636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1498 -0.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6538 -0.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 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 2 1 0 0 0 0
7 5 1 0 0 0 0
2 8 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 1 2 0 0 0 0
3 12 2 0 0 0 0
4 13 1 0 0 0 0
7 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 17 1 0 0 0 0
17 18 2 0 0 0 0
18 7 1 0 0 0 0
13 19 1 0 0 0 0
9 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 10 1 0 0 0 0
S SKP 8
ID FL5F19NF0002
KNApSAcK_ID C00013534
NAME Ponganone XI;6-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one
CAS_RN 142608-97-7
FORMULA C18H12O4
EXACTMASS 292.073558872
AVERAGEMASS 292.28548
SMILES c(c12)c(C3=O)c(OC(c(c4)cccc4)=C3OC)cc1occ2
M END
