Mol:FL3FECGS0005
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 33 36 0 0 0 0 0 0 0 0999 V2000 | + | 33 36 0 0 0 0 0 0 0 0999 V2000 |
| − | 0.0193 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0193 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0193 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0193 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4703 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4703 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9214 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9214 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9214 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9214 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4703 0.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4703 0.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3725 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3725 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8235 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8235 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8235 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8235 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3725 0.5660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3725 0.5660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3725 -0.8818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3725 -0.8818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2744 0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2744 0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7341 0.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7341 0.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1939 0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1939 0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1939 1.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1939 1.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7341 1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7341 1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2744 1.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2744 1.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7341 1.9659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7341 1.9659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7841 1.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7841 1.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4703 -0.9954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4703 -0.9954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4308 0.5655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4308 0.5655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4308 -0.4751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4308 -0.4751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0703 -0.8599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0703 -0.8599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5547 -1.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5547 -1.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8122 -1.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8122 -1.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0957 -1.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0957 -1.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6163 -0.7233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6163 -0.7233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2659 -1.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2659 -1.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5340 -0.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5340 -0.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7841 -1.2720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7841 -1.2720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3585 -1.5796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3585 -1.5796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3867 -1.9659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3867 -1.9659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8606 -0.4886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8606 -0.4886 0.0000 O 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 |
| − | 16 18 1 0 0 0 0 | + | 16 18 1 0 0 0 0 |
| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 2 22 1 0 0 0 0 | + | 2 22 1 0 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 24 25 1 1 0 0 0 | + | 24 25 1 1 0 0 0 |
| − | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 23 1 0 0 0 0 | + | 28 23 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
| − | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
| − | 25 32 1 0 0 0 0 | + | 25 32 1 0 0 0 0 |
| − | 33 29 1 0 0 0 0 | + | 33 29 1 0 0 0 0 |
| − | 26 22 1 0 0 0 0 | + | 26 22 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FECGS0005 | + | ID FL3FECGS0005 |
| − | KNApSAcK_ID C00004380 | + | KNApSAcK_ID C00004380 |
| − | NAME 6-Hydroxyluteolin 6-glucoside | + | NAME 6-Hydroxyluteolin 6-glucoside |
| − | CAS_RN 72380-28-0 | + | CAS_RN 72380-28-0 |
| − | FORMULA C21H20O12 | + | FORMULA C21H20O12 |
| − | EXACTMASS 464.095476104 | + | EXACTMASS 464.095476104 |
| − | AVERAGEMASS 464.37629999999996 | + | AVERAGEMASS 464.37629999999996 |
| − | SMILES C(C1Oc(c(O)2)c(O)cc(O3)c(C(=O)C=C3c(c4)cc(c(O)c4)O)2)(O)C(O)C(O)C(O1)CO | + | SMILES C(C1Oc(c(O)2)c(O)cc(O3)c(C(=O)C=C3c(c4)cc(c(O)c4)O)2)(O)C(O)C(O)C(O1)CO |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
33 36 0 0 0 0 0 0 0 0999 V2000
0.0193 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0193 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4703 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9214 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9214 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4703 0.5660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3725 -0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8235 -0.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8235 0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3725 0.5660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3725 -0.8818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2744 0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7341 0.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1939 0.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1939 1.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7341 1.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2744 1.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7341 1.9659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7841 1.4375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4703 -0.9954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4308 0.5655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4308 -0.4751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0703 -0.8599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5547 -1.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8122 -1.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0957 -1.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6163 -0.7233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2659 -1.0661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5340 -0.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7841 -1.2720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3585 -1.5796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3867 -1.9659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8606 -0.4886 0.0000 O 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
16 18 1 0 0 0 0
19 15 1 0 0 0 0
3 20 1 0 0 0 0
1 21 1 0 0 0 0
2 22 1 0 0 0 0
23 24 1 1 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
28 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
25 32 1 0 0 0 0
33 29 1 0 0 0 0
26 22 1 0 0 0 0
S SKP 8
ID FL3FECGS0005
KNApSAcK_ID C00004380
NAME 6-Hydroxyluteolin 6-glucoside
CAS_RN 72380-28-0
FORMULA C21H20O12
EXACTMASS 464.095476104
AVERAGEMASS 464.37629999999996
SMILES C(C1Oc(c(O)2)c(O)cc(O3)c(C(=O)C=C3c(c4)cc(c(O)c4)O)2)(O)C(O)C(O)C(O1)CO
M END
