Mol:FL7AAGGA0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-2.3680 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3680 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6532 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9385 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9385 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6532 1.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2237 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4910 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4910 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2237 1.8621 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.2055 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9341 1.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6626 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6626 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9341 3.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2055 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9341 3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0825 1.8620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3908 3.1237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6532 -0.6135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3908 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8429 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1875 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5247 -1.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8580 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5133 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1761 -1.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5869 -1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0735 -2.4061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8580 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3610 0.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5107 -2.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2749 -3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8947 -3.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5842 -3.3415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8201 -2.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2003 -2.9953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8093 -3.0798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2265 -0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6296 -0.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2983 -0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7810 -1.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3780 -0.7097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7093 -0.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8220 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1184 -0.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5826 0.0534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4986 -1.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6684 -1.9529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6132 -3.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6420 -3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6453 -3.9364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8201 -1.7150 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 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 5 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 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 11 1 0 0 0 0
15 17 1 0 0 0 0
1 18 1 0 0 0 0
14 19 1 0 0 0 0
3 20 1 0 0 0 0
13 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
24 29 1 0 0 0 0
25 30 1 0 0 0 0
20 26 1 0 0 0 0
31 8 1 0 0 0 0
32 33 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 32 1 0 0 0 0
32 38 1 0 0 0 0
39 40 1 0 0 0 0
40 41 1 1 0 0 0
41 42 1 1 0 0 0
43 42 1 1 0 0 0
43 44 1 0 0 0 0
44 39 1 0 0 0 0
39 45 1 0 0 0 0
44 46 1 0 0 0 0
43 47 1 0 0 0 0
42 48 1 0 0 0 0
36 49 1 0 0 0 0
48 49 1 0 0 0 0
33 50 1 0 0 0 0
34 51 1 0 0 0 0
35 52 1 0 0 0 0
40 31 1 0 0 0 0
23 53 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AAGGA0005
FORMULA C33H41O20
EXACTMASS 757.219118752
AVERAGEMASS 757.6666399999999
SMILES C(O1)(Oc(c6)c(c2)c(cc6O)[o+1]c(c(c5)cc(O)c(c(O)5)O)c2OC(C4O)OC(C(C4O)O)COC(C3O)OC(C(O)C(O)3)C)C(C(C(C1C)O)O)O
M END
