Mol:FL5FACGL0032
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
52 57 0 0 0 0 0 0 0 0999 V2000
-2.3917 0.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3917 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6906 -0.3796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9895 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9895 0.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6906 1.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2884 -0.3796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4127 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4127 0.8347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2884 1.2396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2870 -1.1979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1136 1.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8282 0.8268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5428 1.2394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5428 2.0644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8282 2.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1136 2.0644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0926 1.2394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1790 -0.4664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6906 -1.1889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3417 2.5257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4637 -1.7293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7292 -1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9622 -2.1207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7292 -2.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4637 -3.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2306 -2.5498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4602 -0.8193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7518 -2.9488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2516 -3.9790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3960 -0.3357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9535 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7563 -0.7595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5312 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9682 -0.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2657 -0.5587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2713 -1.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4241 -1.2650 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2712 -0.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8282 3.3019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5831 1.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7914 1.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0426 1.9687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7914 2.8531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5831 3.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3319 2.4311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1849 3.9790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7900 3.5046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9809 2.9299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2712 1.5724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7122 -3.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5404 -3.5188 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
1 18 1 0 0 0 0
8 19 1 0 0 0 0
3 20 1 0 0 0 0
21 15 1 0 0 0 0
22 23 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 22 1 0 0 0 0
22 28 1 0 0 0 0
27 29 1 0 0 0 0
26 30 1 0 0 0 0
23 19 1 0 0 0 0
31 32 1 1 0 0 0
32 33 1 1 0 0 0
34 33 1 1 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 31 1 0 0 0 0
32 37 1 0 0 0 0
33 38 1 0 0 0 0
28 31 1 0 0 0 0
34 39 1 0 0 0 0
16 40 1 0 0 0 0
42 41 1 1 0 0 0
42 43 1 0 0 0 0
43 44 1 0 0 0 0
44 45 1 0 0 0 0
45 46 1 1 0 0 0
46 41 1 1 0 0 0
45 47 1 0 0 0 0
44 48 1 0 0 0 0
46 49 1 0 0 0 0
41 50 1 0 0 0 0
42 18 1 0 0 0 0
51 52 1 0 0 0 0
25 51 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 51 52
M SBL 1 1 57
M SMT 1 ^ CH2OH
M SBV 1 57 0.0169 0.7167
S SKP 5
ID FL5FACGL0032
FORMULA C32H38O20
EXACTMASS 742.1956436559999
AVERAGEMASS 742.63212
SMILES O(C(C)1)C(Oc(c6)cc(c(c36)C(=O)C(OC(C4OC(O5)C(C(O)C(O)C5)O)OC(CO)C(O)C(O)4)=C(O3)c(c2)ccc(c(O)2)O)O)C(O)C(O)C1O
M END
