Mol:FL5FFANM0002
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 28 0 0 0 0 0 0 0 0999 V2000 | + | 26 28 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.7597 -0.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7597 -0.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7550 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7550 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0499 -1.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0499 -1.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6692 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6692 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6739 0.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6739 0.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0382 0.6118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0382 0.6118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1029 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1029 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3907 0.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3907 0.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4648 0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4648 0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1839 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1839 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1886 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1886 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4788 -1.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4788 -1.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8119 0.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8119 0.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8091 1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8091 1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0967 1.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0967 1.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3877 1.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3877 1.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4788 -1.8551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4788 -1.8551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0499 -1.8632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0499 -1.8632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5235 1.8587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5235 1.8587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8543 0.5985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8543 0.5985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3321 -1.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3321 -1.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9753 -0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9753 -0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4648 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4648 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8518 -0.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8518 -0.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1197 1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1197 1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5235 0.2122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5235 0.2122 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 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 5 1 0 0 0 0 | + | 8 5 1 0 0 0 0 |
| − | 2 9 2 0 0 0 0 | + | 2 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 1 2 0 0 0 0 | + | 12 1 2 0 0 0 0 |
| − | 7 13 2 0 0 0 0 | + | 7 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 8 2 0 0 0 0 | + | 16 8 2 0 0 0 0 |
| − | 12 17 1 0 0 0 0 | + | 12 17 1 0 0 0 0 |
| − | 3 18 2 0 0 0 0 | + | 3 18 2 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 10 20 1 0 0 0 0 | + | 10 20 1 0 0 0 0 |
| − | 4 21 1 0 0 0 0 | + | 4 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 9 23 1 0 0 0 0 | + | 9 23 1 0 0 0 0 |
| − | 11 24 1 0 0 0 0 | + | 11 24 1 0 0 0 0 |
| − | 23 25 1 0 0 0 0 | + | 23 25 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FFANM0002 | + | ID FL5FFANM0002 |
| − | KNApSAcK_ID C00013508 | + | KNApSAcK_ID C00013508 |
| − | NAME 5-Hydroxy-2-(4-hydroxyphenyl)-3,7,8-trimethoxy-6-methyl-4H-1-benzopyran-4-one | + | NAME 5-Hydroxy-2-(4-hydroxyphenyl)-3,7,8-trimethoxy-6-methyl-4H-1-benzopyran-4-one |
| − | CAS_RN 194157-52-3 | + | CAS_RN 194157-52-3 |
| − | FORMULA C19H18O7 | + | FORMULA C19H18O7 |
| − | EXACTMASS 358.10525293 | + | EXACTMASS 358.10525293 |
| − | AVERAGEMASS 358.34202000000005 | + | AVERAGEMASS 358.34202000000005 |
| − | SMILES c(C(O2)=C(C(c(c3O)c2c(c(c3C)OC)OC)=O)OC)(c1)ccc(O)c1 | + | SMILES c(C(O2)=C(C(c(c3O)c2c(c(c3C)OC)OC)=O)OC)(c1)ccc(O)c1 |
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 28 0 0 0 0 0 0 0 0999 V2000
-0.7597 -0.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7550 0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0499 -1.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6692 -0.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6739 0.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0382 0.6118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1029 0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3907 0.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4648 0.6199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1839 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1886 -0.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 -1.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8119 0.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8091 1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0967 1.8632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3877 1.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4788 -1.8551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0499 -1.8632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5235 1.8587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8543 0.5985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3321 -1.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9753 -0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4648 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8518 -0.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1197 1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5235 0.2122 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 8 1 0 0 0 0
8 5 1 0 0 0 0
2 9 2 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
11 12 1 0 0 0 0
12 1 2 0 0 0 0
7 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 8 2 0 0 0 0
12 17 1 0 0 0 0
3 18 2 0 0 0 0
14 19 1 0 0 0 0
10 20 1 0 0 0 0
4 21 1 0 0 0 0
21 22 1 0 0 0 0
9 23 1 0 0 0 0
11 24 1 0 0 0 0
23 25 1 0 0 0 0
20 26 1 0 0 0 0
S SKP 8
ID FL5FFANM0002
KNApSAcK_ID C00013508
NAME 5-Hydroxy-2-(4-hydroxyphenyl)-3,7,8-trimethoxy-6-methyl-4H-1-benzopyran-4-one
CAS_RN 194157-52-3
FORMULA C19H18O7
EXACTMASS 358.10525293
AVERAGEMASS 358.34202000000005
SMILES c(C(O2)=C(C(c(c3O)c2c(c(c3C)OC)OC)=O)OC)(c1)ccc(O)c1
M END
