Mol:FL5FA9NM0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 21 23 0 0 0 0 0 0 0 0999 V2000 | + | 21 23 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.6796 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6796 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6796 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6796 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1233 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1233 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5670 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5670 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5670 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5670 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1233 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1233 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0107 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0107 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5456 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5456 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5456 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5456 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0107 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0107 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0107 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0107 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1017 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1017 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6687 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6687 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2357 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2357 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2357 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2357 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6687 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6687 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1017 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1017 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1017 -0.8121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1017 -0.8121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2357 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2357 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1233 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1233 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1233 1.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1233 1.1146 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 |
| − | 8 18 1 0 0 0 0 | + | 8 18 1 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 6 21 1 0 0 0 0 | + | 6 21 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FA9NM0001 | + | ID FL5FA9NM0001 |
| − | KNApSAcK_ID C00004872 | + | KNApSAcK_ID C00004872 |
| − | NAME 8-C-Methylgalangin | + | NAME 8-C-Methylgalangin |
| − | CAS_RN 97208-78-1 | + | CAS_RN 97208-78-1 |
| − | FORMULA C16H12O5 | + | FORMULA C16H12O5 |
| − | EXACTMASS 284.068473494 | + | EXACTMASS 284.068473494 |
| − | AVERAGEMASS 284.26348 | + | AVERAGEMASS 284.26348 |
| − | SMILES Oc(c3)c(C)c(O1)c(c(O)3)C(=O)C(O)=C(c(c2)cccc2)1 | + | SMILES Oc(c3)c(C)c(O1)c(c(O)3)C(=O)C(O)=C(c(c2)cccc2)1 |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
21 23 0 0 0 0 0 0 0 0999 V2000
-1.6796 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6796 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1233 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5670 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5670 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1233 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0107 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5456 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5456 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0107 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0107 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1017 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2357 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2357 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1017 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1017 -0.8121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2357 0.4723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1233 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1233 1.1146 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
8 18 1 0 0 0 0
1 19 1 0 0 0 0
3 20 1 0 0 0 0
6 21 1 0 0 0 0
S SKP 8
ID FL5FA9NM0001
KNApSAcK_ID C00004872
NAME 8-C-Methylgalangin
CAS_RN 97208-78-1
FORMULA C16H12O5
EXACTMASS 284.068473494
AVERAGEMASS 284.26348
SMILES Oc(c3)c(C)c(O1)c(c(O)3)C(=O)C(O)=C(c(c2)cccc2)1
M END
