Mol:FL5FACGA0020
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-2.8040 1.3605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8040 0.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1030 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4020 0.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4020 1.3605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1030 1.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7010 0.1463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 1.3605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7010 1.7652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7010 -0.4849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8828 1.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5973 1.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3118 1.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3118 2.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5973 3.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8828 2.7460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1030 -0.6629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0764 3.1874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7099 0.0349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5973 3.9832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6414 1.8439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5761 -1.1709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4902 -1.1709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8332 -0.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6087 0.3561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6944 0.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3515 -0.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1921 0.2059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0711 -1.6660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6414 -1.7613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4451 -0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3721 -1.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5261 -0.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7945 -1.4995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5261 -2.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3920 -2.8211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1037 -1.9937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2176 -0.2379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6301 -2.3623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1457 -2.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7763 -3.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4887 -3.8221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9566 -3.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2731 -3.9832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4899 -3.2243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2731 -2.4607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9566 -2.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7398 -2.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6265 -1.4879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3357 -1.9007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3497 -2.2403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6530 -3.5466 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
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 15 1 0 0 0 0
20 8 1 0 0 0 0
4 3 1 0 0 0 0
16 21 1 0 0 0 0
1 22 1 0 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 1 0 0 0
28 23 1 1 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 34 1 0 0 0 0
34 35 1 1 0 0 0
35 36 1 1 0 0 0
37 36 1 1 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
33 39 1 0 0 0 0
38 40 1 0 0 0 0
37 41 1 0 0 0 0
36 42 1 0 0 0 0
34 20 1 0 0 0 0
27 39 1 0 0 0 0
43 42 1 0 0 0 0
45 44 1 1 0 0 0
45 46 1 0 0 0 0
46 47 1 0 0 0 0
47 48 1 0 0 0 0
48 49 1 1 0 0 0
49 44 1 1 0 0 0
48 50 1 0 0 0 0
47 51 1 0 0 0 0
49 52 1 0 0 0 0
44 53 1 0 0 0 0
45 43 1 0 0 0 0
S SKP 5
ID FL5FACGA0020
FORMULA C33H40O20
EXACTMASS 756.21129372
AVERAGEMASS 756.6587
SMILES OC(C6O)C(C(OC6C)OC(C(OC(=C4c(c5)cc(c(c5)O)O)C(=O)c(c(O4)3)c(cc(O)c3)O)1)C(O)C(C(COC(C(O)2)OC(C)C(O)C(O)2)O1)O)O
M END
