Mol:FL5FACGA0016
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-3.0310 1.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0310 0.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3298 0.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6286 0.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6286 1.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3298 2.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9274 0.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2261 0.9660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2261 1.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9274 2.1806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9274 -0.0701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4748 2.1805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1895 1.7678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9042 2.1805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9042 3.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1895 3.4183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4748 3.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7320 2.1805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4990 0.5363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3298 -0.2482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0995 -0.9281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6763 -1.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4901 -1.4284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3087 -1.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.9281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9182 -1.1606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3136 -1.1387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6708 1.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2476 0.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0614 0.5233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8800 0.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3032 1.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4894 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9481 0.8942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7640 1.2051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1947 1.7236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5748 0.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6596 -0.3400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1486 -1.5196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9789 -2.0827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3087 -2.3751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7033 3.4670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1895 4.2433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4580 -2.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0348 -3.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8486 -3.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6672 -3.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0905 -2.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2767 -3.0288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3279 -3.0069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4929 -3.3878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3168 -3.9303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6672 -4.2433 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 22 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
21 27 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 1 0 0 0
30 31 1 1 0 0 0
32 31 1 1 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
28 34 1 0 0 0 0
33 35 1 0 0 0 0
32 36 1 0 0 0 0
31 37 1 0 0 0 0
25 38 1 0 0 0 0
37 38 1 0 0 0 0
22 39 1 0 0 0 0
23 40 1 0 0 0 0
24 41 1 0 0 0 0
29 19 1 0 0 0 0
42 15 1 0 0 0 0
16 43 1 0 0 0 0
44 45 1 0 0 0 0
45 46 1 1 0 0 0
46 47 1 1 0 0 0
48 47 1 1 0 0 0
48 49 1 0 0 0 0
49 44 1 0 0 0 0
44 50 1 0 0 0 0
45 51 1 0 0 0 0
46 52 1 0 0 0 0
47 53 1 0 0 0 0
48 40 1 0 0 0 0
S SKP 5
ID FL5FACGA0016
FORMULA C33H40O20
EXACTMASS 756.21129372
AVERAGEMASS 756.6587
SMILES c(c21)(OC(c(c6)ccc(O)c6O)=C(OC(O3)C(C(C(C3COC(C4O)OC(C(O)C(OC(C(O)5)OC(C(O)C5O)C)4)C)O)O)O)C2=O)cc(cc1O)O
M END
