Mol:FL5FAAGA0019
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
51 56 0 0 0 0 0 0 0 0999 V2000
-2.2626 0.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2626 0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5616 -0.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8606 0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8606 0.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5616 1.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1596 -0.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5414 0.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5414 0.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1596 1.2997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1596 -0.9504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2422 1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9567 0.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6712 1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6712 2.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9567 2.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2422 2.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5616 -1.1285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9634 1.2995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3855 2.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2458 -0.3441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5551 1.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7634 1.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0147 2.0028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7634 2.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5551 3.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3040 2.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0501 3.8493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7634 3.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8703 2.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.1813 1.5653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7226 -1.6370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8765 -1.1486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1449 -2.0881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8765 -3.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7226 -3.5217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4541 -2.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6472 -0.7945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9491 -2.9900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4434 -3.3285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3862 -0.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9437 -1.2274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7465 -0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5211 -0.9068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9582 -0.3438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2559 -0.7145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3029 -1.1474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5378 -1.4000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1813 -0.6607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8425 -3.8493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1074 -3.1141 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
3 18 1 0 0 0 0
1 19 1 0 0 0 0
15 20 1 0 0 0 0
8 21 1 0 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 26 1 0 0 0 0
26 27 1 1 0 0 0
27 22 1 1 0 0 0
26 28 1 0 0 0 0
25 29 1 0 0 0 0
27 30 1 0 0 0 0
22 31 1 0 0 0 0
23 19 1 0 0 0 0
32 33 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 32 1 0 0 0 0
32 38 1 0 0 0 0
37 39 1 0 0 0 0
36 40 1 0 0 0 0
33 21 1 0 0 0 0
41 42 1 1 0 0 0
42 43 1 1 0 0 0
44 43 1 1 0 0 0
44 45 1 0 0 0 0
45 46 1 0 0 0 0
46 41 1 0 0 0 0
42 47 1 0 0 0 0
43 48 1 0 0 0 0
38 41 1 0 0 0 0
44 49 1 0 0 0 0
50 51 1 0 0 0 0
35 50 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 50 51
M SBL 1 1 56
M SMT 1 ^CH2OH
M SBV 1 56 0.0340 0.8162
S SKP 5
ID FL5FAAGA0019
FORMULA C32H38O19
EXACTMASS 726.200729034
AVERAGEMASS 726.6327200000001
SMILES Oc(c1)ccc(C(O6)=C(C(=O)c(c64)c(cc(OC(C5O)OC(C)C(C5O)O)c4)O)OC(C(OC(O3)C(C(O)C(O)C3)O)2)OC(CO)C(O)C(O)2)c1
M END
