Mol:FL5FAAGA0015
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
52 57 0 0 0 0 0 0 0 0999 V2000
-3.0689 1.9294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0689 1.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3677 0.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6665 1.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6665 1.9294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3677 2.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9654 0.7149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2642 1.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2642 1.9294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9654 2.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9654 0.0837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4367 2.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1514 1.9215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8659 2.3341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8659 3.1593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1514 3.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4367 3.1593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3677 -0.0944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7698 2.3341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5804 3.5717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5374 0.6845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1168 -0.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6937 -1.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5074 -1.2189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3259 -1.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7698 -0.6980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9354 -0.9511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4148 -0.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6143 1.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1912 0.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0050 0.8672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8236 0.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2468 1.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4330 1.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8285 1.1569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7489 1.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0420 2.0831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4976 0.7776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6856 0.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1659 -1.3101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1186 -1.8924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3259 -2.1655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3994 -2.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8226 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0088 -2.6252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8097 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2329 -2.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4192 -2.3574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0808 -2.2338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3503 -2.7165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3977 -3.2988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8097 -3.5718 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
3 18 1 0 0 0 0
1 19 1 0 0 0 0
15 20 1 0 0 0 0
8 21 1 0 0 0 0
22 23 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 22 1 0 0 0 0
22 28 1 0 0 0 0
29 30 1 0 0 0 0
30 31 1 1 0 0 0
31 32 1 1 0 0 0
33 32 1 1 0 0 0
33 34 1 0 0 0 0
34 29 1 0 0 0 0
29 35 1 0 0 0 0
34 36 1 0 0 0 0
33 37 1 0 0 0 0
32 38 1 0 0 0 0
26 39 1 0 0 0 0
38 39 1 0 0 0 0
23 40 1 0 0 0 0
24 41 1 0 0 0 0
25 42 1 0 0 0 0
30 21 1 0 0 0 0
43 44 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 43 1 0 0 0 0
43 49 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 40 1 0 0 0 0
S SKP 5
ID FL5FAAGA0015
FORMULA C33H40O19
EXACTMASS 740.216379098
AVERAGEMASS 740.6593
SMILES O(CC(O3)C(C(C(O)C3OC(C5=O)=C(Oc(c6)c5c(O)cc6O)c(c4)ccc(O)c4)O)O)C(O1)C(O)C(C(OC(O2)C(C(C(C(C)2)O)O)O)C1C)O
M END
