Mol:FL5FACGS0077
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
52 57 0 0 0 0 0 0 0 0999 V2000
-2.0785 1.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6661 2.4950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0784 3.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9034 3.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3159 2.4950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9035 1.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8410 2.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4285 1.7807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3965 1.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8090 2.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3965 3.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4285 3.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8089 1.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6339 1.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0464 1.7807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6339 2.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8090 3.9239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2362 0.4097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8410 3.9240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0464 3.2096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9994 2.4950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2663 3.8381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8249 -2.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5396 -1.8675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3304 -1.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5573 -0.2757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8426 -0.6883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0517 -1.4867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5683 -1.8403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9688 -1.6860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8902 -3.0345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3298 -2.4739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1324 -0.3788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9994 2.3788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2515 2.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3903 1.2165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0951 0.4458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8431 0.7945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7044 1.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7078 0.7628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3465 2.7394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9609 3.1407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5560 -2.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0358 -3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2242 -2.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5502 -3.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0300 -2.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2183 -2.6997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6050 -3.9240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8202 -3.5003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6223 -2.9232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3035 -2.5816 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 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 28 1 0 0 0 0
28 23 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 33 1 0 0 0 0
26 18 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 39 1 0 0 0 0
39 34 1 0 0 0 0
36 40 1 0 0 0 0
35 41 1 0 0 0 0
34 42 1 0 0 0 0
37 33 1 0 0 0 0
43 44 1 0 0 0 0
44 45 1 1 0 0 0
46 45 1 1 0 0 0
47 46 1 1 0 0 0
47 48 1 0 0 0 0
48 43 1 0 0 0 0
46 49 1 0 0 0 0
45 50 1 0 0 0 0
44 51 1 0 0 0 0
43 52 1 0 0 0 0
47 30 1 0 0 0 0
S SKP 5
ID FL5FACGS0077
FORMULA C32H38O20
EXACTMASS 742.1956436559999
AVERAGEMASS 742.63212
SMILES O(C(OC(C(O)6)C(OC(C(O)6)COC(O5)C(O)C(C(C5C)O)O)Oc(c2)cc(O3)c(C(=O)C(=C3c(c4)ccc(c4O)O)O)c2O)1)CC(O)C(O)C1O
M END
