Mol:FL5FCDGL0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
45 49 0 0 0 0 0 0 0 0999 V2000
-3.3450 0.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3450 -0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 -0.6151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9430 -0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9430 0.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 1.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2420 -0.6151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5410 -0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5410 0.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2420 1.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2420 -1.2462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1598 1.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8743 0.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5887 1.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5887 1.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8743 2.2412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1598 1.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 -1.4242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5725 -2.3643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0841 -3.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0235 -2.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9685 -3.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5475 -2.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5176 -2.6327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7548 -2.5202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5671 -0.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0787 -1.1422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0180 -0.8737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9631 -1.1422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4517 -0.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5122 -0.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2393 -0.7071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1274 0.0009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3105 -0.4819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7365 -1.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4263 -1.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4038 -3.0579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3696 -3.5970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9685 -4.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8309 -0.3055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3513 2.2099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8822 2.9040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4383 4.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9175 1.0269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5475 2.1183 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
3 18 1 0 0 0 0
19 20 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 19 1 0 0 0 0
19 25 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 1 0 0 0
28 29 1 1 0 0 0
30 29 1 1 0 0 0
30 31 1 0 0 0 0
31 26 1 0 0 0 0
31 33 1 0 0 0 0
30 34 1 0 0 0 0
29 35 1 0 0 0 0
23 36 1 0 0 0 0
35 36 1 0 0 0 0
20 37 1 0 0 0 0
21 38 1 0 0 0 0
22 39 1 0 0 0 0
32 8 1 0 0 0 0
27 32 1 0 0 0 0
26 40 1 0 0 0 0
15 41 1 0 0 0 0
42 43 1 0 0 0 0
16 42 1 0 0 0 0
44 45 1 0 0 0 0
1 44 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 42 43
M SBL 1 1 47
M SMT 1 OCH3
M SBV 1 47 -0.0079 -0.6628
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 44 45
M SBL 2 1 49
M SMT 2 ^ OCH3
M SBV 2 49 0.5725 -0.4278
S SKP 5
ID FL5FCDGL0002
FORMULA C29H34O16
EXACTMASS 638.18468504
AVERAGEMASS 638.57066
SMILES c(c(O)5)c(OC)cc(c51)OC(c(c4)ccc(O)c4OC)=C(OC(O2)C(O)C(O)C(C2COC(O3)C(C(C(O)C(C)3)O)O)O)C(=O)1
M END
