Mol:FL5FCAGS0013
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
52 56 0 0 0 0 0 0 0 0999 V2000
1.4949 3.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4949 2.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2093 2.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9238 2.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9238 3.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2093 4.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7804 2.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0659 2.9072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6484 2.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6484 1.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0659 1.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7804 1.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3629 2.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0774 2.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0774 1.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3629 1.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0659 0.5389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7918 2.9072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4580 1.2349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5245 4.0790 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3629 0.5576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5245 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4821 -0.6888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1962 -1.1588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8288 -0.6287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6431 -0.4950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9648 -0.0249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3322 -0.5549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0809 0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3184 0.0052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4821 -0.2395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4987 -1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7547 -1.0054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2270 -2.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2270 -3.1715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4109 -3.1927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2285 -1.9336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7731 -2.2045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1437 -2.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4109 -2.5701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8113 -1.9607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3638 -1.7749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3280 -4.1447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7275 -3.4229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3020 -2.7160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5523 -3.4078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7103 -2.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3390 -1.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5172 -1.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4532 -2.4656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6896 -0.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4737 -0.6961 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
5 20 1 0 0 0 0
16 21 1 0 0 0 0
18 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
40 34 1 1 0 0 0
39 34 1 1 0 0 0
38 40 1 1 0 0 0
34 35 1 0 0 0 0
40 36 1 0 0 0 0
41 38 1 0 0 0 0
37 42 1 0 0 0 0
39 41 1 0 0 0 0
34 37 1 0 0 0 0
33 38 1 0 0 0 0
26 19 1 0 0 0 0
43 44 1 0 0 0 0
44 45 1 0 0 0 0
44 46 2 0 0 0 0
45 47 1 0 0 0 0
47 48 1 0 0 0 0
47 49 1 0 0 0 0
47 50 1 0 0 0 0
48 51 1 0 0 0 0
51 52 2 0 0 0 0
30 51 1 0 0 0 0
S SKP 5
ID FL5FCAGS0013
FORMULA C33H38O19
EXACTMASS 738.200729034
AVERAGEMASS 738.64342
SMILES c(c1)(ccc(C(O2)=C(OC(O5)C(C(O)C(O)C(COC(=O)CC(C)(O)CC(O)=O)5)OC(O4)C(C(O)(CO)C4)O)C(=O)c(c(O)3)c2cc(OC)c3)c1)O
M END
