Mol:FL5FACGS0119
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
69 75 0 0 0 0 0 0 0 0999 V2000
3.1353 1.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4208 2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4208 3.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1353 3.4156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8498 3.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8498 2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7064 1.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9919 2.1781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2774 1.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2774 0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9919 0.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7064 0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4370 2.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1515 1.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1515 0.9406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4370 0.5281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9919 -0.1327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8233 2.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3053 0.4951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4370 -0.1986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4417 3.3448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1353 4.1414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3763 1.3738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7889 0.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9954 0.8859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1971 0.6766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7844 1.3913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5780 1.1646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1991 -0.0386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5321 0.2620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3306 0.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9884 1.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5299 -1.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3523 -1.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6362 -0.9665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2753 -0.4445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4530 -0.3753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1690 -1.1503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6203 -1.1731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1934 -1.5855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2399 -2.2639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8025 -2.1491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3953 -0.9789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2196 -3.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0159 -3.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0176 -2.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4396 -1.7572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6432 -1.9736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6414 -2.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8548 -3.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1522 -4.1414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6317 -3.9496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7383 -2.1372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5298 -3.9905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1112 -3.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5164 -2.5635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7127 -3.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1313 -2.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9551 -2.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3743 -1.8760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1992 -1.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6050 -2.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1859 -3.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3609 -3.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4289 -2.6097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5912 -4.0299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4150 -4.0376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6178 -1.1741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4417 -1.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
12 19 1 0 0 0 0
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
27 26 1 1 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
26 29 1 0 0 0 0
25 30 1 0 0 0 0
24 31 1 0 0 0 0
23 32 1 0 0 0 0
27 18 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 38 1 0 0 0 0
38 33 1 0 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
33 41 1 0 0 0 0
34 42 1 0 0 0 0
35 43 1 0 0 0 0
44 45 1 1 0 0 0
45 46 1 1 0 0 0
47 46 1 1 0 0 0
47 48 1 0 0 0 0
48 49 1 0 0 0 0
49 44 1 0 0 0 0
49 50 1 0 0 0 0
44 51 1 0 0 0 0
45 52 1 0 0 0 0
46 53 1 0 0 0 0
47 43 1 0 0 0 0
36 19 1 0 0 0 0
54 55 1 0 0 0 0
55 56 2 0 0 0 0
55 57 1 0 0 0 0
57 58 2 0 0 0 0
58 59 1 0 0 0 0
59 60 2 0 0 0 0
60 61 1 0 0 0 0
61 62 2 0 0 0 0
62 63 1 0 0 0 0
63 64 2 0 0 0 0
64 59 1 0 0 0 0
62 65 1 0 0 0 0
63 66 1 0 0 0 0
66 67 1 0 0 0 0
61 68 1 0 0 0 0
68 69 1 0 0 0 0
54 50 1 0 0 0 0
S SKP 5
ID FL5FACGS0119
FORMULA C44H50O25
EXACTMASS 978.26411715
AVERAGEMASS 978.8528000000001
SMILES O(c(c7)cc(c(c72)C(=O)C(OC(O6)C(C(O)C(C6CO)O)OC(O4)C(C(C(C(COC(C=Cc(c5)cc(OC)c(c(OC)5)O)=O)4)O)O)O)=C(c(c3)ccc(O)c3O)O2)O)C(C1O)OC(C)C(O)C(O)1
M END
