Mol:FL3FGCNS0015
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 23 25 0 0 0 0 0 0 0 0999 V2000 | + | 23 25 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1103 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1103 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1103 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1103 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8248 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8248 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5393 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5393 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5393 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5393 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8248 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8248 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3959 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3959 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3186 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3186 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3186 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3186 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3959 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3959 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0331 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0331 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7475 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7475 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4620 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4620 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4620 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4620 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7475 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7475 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0330 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0330 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3959 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3959 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1765 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1765 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1765 0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1765 0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1606 -0.9775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1606 -0.9775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1765 0.5741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1765 0.5741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8248 -1.6621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8248 -1.6621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8248 1.3578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8248 1.3578 0.0000 O 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 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 13 19 1 0 0 0 0 | + | 13 19 1 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 4 21 1 0 0 0 0 | + | 4 21 1 0 0 0 0 |
| − | 6 22 1 0 0 0 0 | + | 6 22 1 0 0 0 0 |
| − | 3 23 1 0 0 0 0 | + | 3 23 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FGCNS0015 | + | ID FL3FGCNS0015 |
| − | KNApSAcK_ID C00013335 | + | KNApSAcK_ID C00013335 |
| − | NAME 5,6,7,8,3',4'-Hexahydroxyflavone;Bitalgenin;Bitalosidin;Majoranetin;Nornobiletin;2-(3,4-Dihydroxyphenyl)-5,6,7,8-tetrahydroxy-4H-1-benzopyran-4-one | + | NAME 5,6,7,8,3',4'-Hexahydroxyflavone;Bitalgenin;Bitalosidin;Majoranetin;Nornobiletin;2-(3,4-Dihydroxyphenyl)-5,6,7,8-tetrahydroxy-4H-1-benzopyran-4-one |
| − | CAS_RN 2192-25-8 | + | CAS_RN 2192-25-8 |
| − | FORMULA C15H10O8 | + | FORMULA C15H10O8 |
| − | EXACTMASS 318.037567296 | + | EXACTMASS 318.037567296 |
| − | AVERAGEMASS 318.2351 | + | AVERAGEMASS 318.2351 |
| − | SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c(O)1)c(C(=O)2)c(O)c(O)c(O)1 | + | SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c(O)1)c(C(=O)2)c(O)c(O)c(O)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-1.1103 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1103 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8248 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5393 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5393 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8248 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3959 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3186 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3186 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3959 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0331 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7475 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4620 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4620 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7475 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0330 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3959 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1765 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1765 0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1606 -0.9775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1765 0.5741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8248 -1.6621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8248 1.3578 0.0000 O 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
14 18 1 0 0 0 0
13 19 1 0 0 0 0
5 20 1 0 0 0 0
4 21 1 0 0 0 0
6 22 1 0 0 0 0
3 23 1 0 0 0 0
S SKP 8
ID FL3FGCNS0015
KNApSAcK_ID C00013335
NAME 5,6,7,8,3',4'-Hexahydroxyflavone;Bitalgenin;Bitalosidin;Majoranetin;Nornobiletin;2-(3,4-Dihydroxyphenyl)-5,6,7,8-tetrahydroxy-4H-1-benzopyran-4-one
CAS_RN 2192-25-8
FORMULA C15H10O8
EXACTMASS 318.037567296
AVERAGEMASS 318.2351
SMILES Oc(c3)c(O)cc(c3)C(=C2)Oc(c(O)1)c(C(=O)2)c(O)c(O)c(O)1
M END
