Mol:FL5FACGS0099
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
54 59 0 0 0 0 0 0 0 0999 V2000
1.4201 1.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7056 1.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7056 2.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4201 3.1570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1346 2.7445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1346 1.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0088 1.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7233 1.9195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4378 1.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4378 0.6820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7233 0.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0088 0.6820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1523 1.9195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8667 1.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8667 0.6820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1523 0.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7233 -0.3913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5812 1.9195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5901 0.2365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1523 -0.4572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7265 3.0862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4201 3.8828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1666 -0.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1666 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8810 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5955 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5955 -0.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8810 0.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8810 1.0683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3090 0.2439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3090 -1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4530 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4530 -2.2289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2101 -1.9279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3852 -1.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1466 -1.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4612 -0.6010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3638 -0.5796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6024 -1.3696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8298 -0.9828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3366 -2.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8267 -2.5245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3302 -1.4476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7666 -2.0400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2585 -2.0799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9613 -2.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1553 -2.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5525 -3.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8497 -2.8213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6556 -2.6435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3090 -2.1168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7744 -1.9570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9459 -3.0425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7244 -3.8828 0.0000 O 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 2 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
27 28 2 0 0 0 0
28 23 1 0 0 0 0
28 29 1 0 0 0 0
27 30 1 0 0 0 0
26 31 1 0 0 0 0
24 32 1 0 0 0 0
32 33 2 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 39 1 0 0 0 0
39 34 1 0 0 0 0
36 40 1 0 0 0 0
34 41 1 0 0 0 0
35 42 1 0 0 0 0
39 43 1 0 0 0 0
43 44 1 0 0 0 0
45 46 1 0 0 0 0
46 47 1 1 0 0 0
48 47 1 1 0 0 0
49 48 1 1 0 0 0
49 50 1 0 0 0 0
50 45 1 0 0 0 0
46 51 1 0 0 0 0
45 52 1 0 0 0 0
47 53 1 0 0 0 0
48 54 1 0 0 0 0
44 49 1 0 0 0 0
37 19 1 0 0 0 0
40 32 1 0 0 0 0
S SKP 5
ID FL5FACGS0099
FORMULA C34H34O20
EXACTMASS 762.164343528
AVERAGEMASS 762.62176
SMILES c(O2)(c(C(C(OC(C(OC(=O)c(c6)cc(c(O)c6O)O)5)OC(C(O)C(O)5)COC(O4)C(O)C(C(O)C(C)4)O)=C2c(c3)cc(O)c(c3)O)=O)1)cc(cc(O)1)O
M END
