Mol:FL2FBEGS0001
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 34 37 0 0 0 0 0 0 0 0999 V2000 | + | 34 37 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.3085 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3085 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3085 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3085 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6073 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6073 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0939 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0939 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0939 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0939 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6073 0.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6073 0.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7951 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7951 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4963 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4963 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4963 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4963 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7951 0.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7951 0.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1973 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1973 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9120 -0.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9120 -0.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6267 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6267 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6267 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6267 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9120 1.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9120 1.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1973 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1973 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7951 -2.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7951 -2.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0095 0.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0095 0.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9120 2.2022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9120 2.2022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7698 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7698 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3435 -0.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3435 -0.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5186 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5186 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6987 -0.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6987 -0.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1250 0.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1250 0.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9500 0.4019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9500 0.4019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.2417 0.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.2417 0.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.0206 0.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0206 0.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2362 -0.3754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2362 -0.3754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2578 0.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2578 0.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3400 1.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3400 1.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3412 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3412 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2417 0.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2417 0.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1574 -1.6823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1574 -1.6823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2569 -2.2022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2569 -2.2022 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 1 0 0 0 0 | + | 8 9 1 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 |
| − | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
| − | 20 21 1 1 0 0 0 | + | 20 21 1 1 0 0 0 |
| − | 21 22 1 1 0 0 0 | + | 21 22 1 1 0 0 0 |
| − | 23 22 1 1 0 0 0 | + | 23 22 1 1 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 20 1 0 0 0 0 | + | 25 20 1 0 0 0 0 |
| − | 18 23 1 0 0 0 0 | + | 18 23 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 21 27 1 0 0 0 0 | + | 21 27 1 0 0 0 0 |
| − | 22 28 1 0 0 0 0 | + | 22 28 1 0 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 25 29 1 0 0 0 0 | + | 25 29 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 14 31 1 0 0 0 0 | + | 14 31 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 3 33 1 0 0 0 0 | + | 3 33 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 29 30 | + | M SAL 1 2 29 30 |
| − | M SBL 1 1 33 | + | M SBL 1 1 33 |
| − | M SMT 1 ^ CH2OH | + | M SMT 1 ^ CH2OH |
| − | M SBV 1 33 0.3078 -0.5331 | + | M SBV 1 33 0.3078 -0.5331 |
| − | M STY 1 2 SUP | + | M STY 1 2 SUP |
| − | M SLB 1 2 2 | + | M SLB 1 2 2 |
| − | M SAL 2 2 31 32 | + | M SAL 2 2 31 32 |
| − | M SBL 2 1 35 | + | M SBL 2 1 35 |
| − | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
| − | M SBV 2 35 -0.7145 -0.4126 | + | M SBV 2 35 -0.7145 -0.4126 |
| − | M STY 1 3 SUP | + | M STY 1 3 SUP |
| − | M SLB 1 3 3 | + | M SLB 1 3 3 |
| − | M SAL 3 2 33 34 | + | M SAL 3 2 33 34 |
| − | M SBL 3 1 37 | + | M SBL 3 1 37 |
| − | M SMT 3 ^ OCH3 | + | M SMT 3 ^ OCH3 |
| − | M SBV 3 37 0.5501 0.2023 | + | M SBV 3 37 0.5501 0.2023 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL2FBEGS0001 | + | ID FL2FBEGS0001 |
| − | FORMULA C23H26O11 | + | FORMULA C23H26O11 |
| − | EXACTMASS 478.147511674 | + | EXACTMASS 478.147511674 |
| − | AVERAGEMASS 478.44594 | + | AVERAGEMASS 478.44594 |
| − | SMILES C(C1O)(C(C(OC1Oc(c4)cc(c(c42)C(CC(c(c3)ccc(c3O)OC)O2)=O)OC)CO)O)O | + | SMILES C(C1O)(C(C(OC1Oc(c4)cc(c(c42)C(CC(c(c3)ccc(c3O)OC)O2)=O)OC)CO)O)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
34 37 0 0 0 0 0 0 0 0999 V2000
-1.3085 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3085 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6073 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0939 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0939 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6073 0.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7951 -1.4800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4963 -1.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4963 -0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7951 0.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1973 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9120 -0.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6267 0.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6267 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9120 1.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1973 0.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7951 -2.1653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0095 0.1394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9120 2.2022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7698 0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3435 -0.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5186 0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6987 -0.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1250 0.6180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9500 0.4019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2417 0.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0206 0.0791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2362 -0.3754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2578 0.9350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3400 1.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3412 1.3771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2417 0.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1574 -1.6823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2569 -2.2022 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 1 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
7 17 2 0 0 0 0
1 18 1 0 0 0 0
15 19 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
18 23 1 0 0 0 0
20 26 1 0 0 0 0
21 27 1 0 0 0 0
22 28 1 0 0 0 0
29 30 1 0 0 0 0
25 29 1 0 0 0 0
31 32 1 0 0 0 0
14 31 1 0 0 0 0
33 34 1 0 0 0 0
3 33 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 29 30
M SBL 1 1 33
M SMT 1 ^ CH2OH
M SBV 1 33 0.3078 -0.5331
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 31 32
M SBL 2 1 35
M SMT 2 OCH3
M SBV 2 35 -0.7145 -0.4126
M STY 1 3 SUP
M SLB 1 3 3
M SAL 3 2 33 34
M SBL 3 1 37
M SMT 3 ^ OCH3
M SBV 3 37 0.5501 0.2023
S SKP 5
ID FL2FBEGS0001
FORMULA C23H26O11
EXACTMASS 478.147511674
AVERAGEMASS 478.44594
SMILES C(C1O)(C(C(OC1Oc(c4)cc(c(c42)C(CC(c(c3)ccc(c3O)OC)O2)=O)OC)CO)O)O
M END
