Mol:FL3FCBNS0001
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 24 0 0 0 0 0 0 0 0999 V2000 | + | 22 24 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.2249 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2249 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2249 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2249 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7244 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7244 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2240 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2240 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2240 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2240 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7244 0.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7244 0.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7235 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7235 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2231 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2231 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2231 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2231 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7235 0.4074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7235 0.4074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2770 0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2770 0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8074 0.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8074 0.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3377 0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3377 0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3377 1.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3377 1.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8074 1.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8074 1.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2770 1.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2770 1.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7244 -1.3258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7244 -1.3258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7235 -1.3255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7235 -1.3255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5821 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5821 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0821 1.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0821 1.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8676 1.3256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8676 1.3256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5821 0.9131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5821 0.9131 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 |
| − | 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 |
| − | 3 17 1 0 0 0 0 | + | 3 17 1 0 0 0 0 |
| − | 7 18 2 0 0 0 0 | + | 7 18 2 0 0 0 0 |
| − | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 14 21 1 0 0 0 0 | + | 14 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | M STY 1 2 SUP | + | M STY 1 2 SUP |
| − | M SLB 1 2 2 | + | M SLB 1 2 2 |
| − | M SAL 2 2 21 22 | + | M SAL 2 2 21 22 |
| − | M SBL 2 1 23 | + | M SBL 2 1 23 |
| − | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
| − | M SVB 2 23 1.8676 1.3256 | + | M SVB 2 23 1.8676 1.3256 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 19 20 | + | M SAL 1 2 19 20 |
| − | M SBL 1 1 21 | + | M SBL 1 1 21 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SVB 1 21 -2.5821 0.7372 | + | M SVB 1 21 -2.5821 0.7372 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FCBNS0001 | + | ID FL3FCBNS0001 |
| − | KNApSAcK_ID C00001016 | + | KNApSAcK_ID C00001016 |
| − | NAME Apigenin 7,4'-dimethyl ether;5-Hydroxy-4',7-dimethoxyflavone;Genkwanin 4'-methyl ether;7-O-Methylacacetin;Acacetin 7-methyl ether;5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one | + | NAME Apigenin 7,4'-dimethyl ether;5-Hydroxy-4',7-dimethoxyflavone;Genkwanin 4'-methyl ether;7-O-Methylacacetin;Acacetin 7-methyl ether;5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 5128-44-9 | + | CAS_RN 5128-44-9 |
| − | FORMULA C17H14O5 | + | FORMULA C17H14O5 |
| − | EXACTMASS 298.084123558 | + | EXACTMASS 298.084123558 |
| − | AVERAGEMASS 298.29006 | + | AVERAGEMASS 298.29006 |
| − | SMILES COc(c3)ccc(c3)C(=C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1 | + | SMILES COc(c3)ccc(c3)C(=C1)Oc(c2)c(c(O)cc(OC)2)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/
22 24 0 0 0 0 0 0 0 0999 V2000
-2.2249 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2249 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7244 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2240 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2240 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7244 0.4074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7235 -0.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2231 -0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2231 0.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7235 0.4074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2770 0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8074 0.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3377 0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3377 1.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8074 1.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2770 1.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7244 -1.3258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7235 -1.3255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5821 0.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0821 1.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8676 1.3256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5821 0.9131 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
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
3 17 1 0 0 0 0
7 18 2 0 0 0 0
1 19 1 0 0 0 0
19 20 1 0 0 0 0
14 21 1 0 0 0 0
21 22 1 0 0 0 0
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 21 22
M SBL 2 1 23
M SMT 2 OCH3
M SVB 2 23 1.8676 1.3256
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 19 20
M SBL 1 1 21
M SMT 1 OCH3
M SVB 1 21 -2.5821 0.7372
S SKP 8
ID FL3FCBNS0001
KNApSAcK_ID C00001016
NAME Apigenin 7,4'-dimethyl ether;5-Hydroxy-4',7-dimethoxyflavone;Genkwanin 4'-methyl ether;7-O-Methylacacetin;Acacetin 7-methyl ether;5-Hydroxy-7-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 5128-44-9
FORMULA C17H14O5
EXACTMASS 298.084123558
AVERAGEMASS 298.29006
SMILES COc(c3)ccc(c3)C(=C1)Oc(c2)c(c(O)cc(OC)2)C(=O)1
M END
