Mol:FL5FABGI0027
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
68 73 0 0 0 0 0 0 0 0999 V2000
3.0708 1.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3563 2.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3563 3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0708 3.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7854 3.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7854 2.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6417 1.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9273 2.2375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2127 1.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2127 0.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9273 0.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6417 0.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5018 2.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2163 1.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2163 0.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5018 0.5873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9273 -0.1197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3888 3.4109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4586 0.5230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5018 -0.0883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8850 2.2111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5018 3.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1052 3.3492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1052 4.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4417 4.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7922 4.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0934 3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4878 2.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0751 2.0685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2767 2.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4831 2.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8957 2.7657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6942 2.5566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9736 3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6597 3.0674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0934 2.5462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7699 2.2231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7868 1.6363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1171 -0.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8264 -1.2865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5724 -0.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3943 -1.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6849 -0.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9389 -0.5904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4843 -1.5913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0982 -1.6175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3109 -1.0926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4381 -0.6533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2773 -1.0926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5773 -0.5732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5765 -1.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3808 -2.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6244 -3.1929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1060 -2.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6674 -2.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0890 -1.9320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6075 -2.5741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1640 -2.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7972 -2.7731 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7716 -3.4970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1792 -3.4377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7354 -2.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4645 -2.7731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7635 -2.2552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7028 -3.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7716 -4.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3335 -4.4420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2223 -4.4709 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
11 17 2 0 0 0 0
5 18 1 0 0 0 0
12 19 1 0 0 0 0
16 20 1 0 0 0 0
14 21 1 0 0 0 0
13 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
18 27 1 0 0 0 0
28 29 1 1 0 0 0
29 30 1 1 0 0 0
31 30 1 1 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
28 36 1 0 0 0 0
29 37 1 0 0 0 0
30 38 1 0 0 0 0
31 21 1 0 0 0 0
39 40 1 0 0 0 0
40 41 1 1 0 0 0
42 41 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
42 45 1 0 0 0 0
41 46 1 0 0 0 0
40 47 1 0 0 0 0
39 48 1 0 0 0 0
43 19 1 0 0 0 0
47 49 1 0 0 0 0
49 50 2 0 0 0 0
49 51 1 0 0 0 0
52 53 1 1 0 0 0
53 54 1 1 0 0 0
55 54 1 1 0 0 0
55 56 1 0 0 0 0
56 57 1 0 0 0 0
57 52 1 0 0 0 0
57 58 1 0 0 0 0
58 59 1 0 0 0 0
52 60 1 0 0 0 0
53 61 1 0 0 0 0
54 62 1 0 0 0 0
55 46 1 0 0 0 0
59 63 1 0 0 0 0
63 64 2 0 0 0 0
63 65 1 0 0 0 0
60 66 1 0 0 0 0
66 67 2 0 0 0 0
66 68 1 0 0 0 0
S SKP 5
ID FL5FABGI0027
FORMULA C45H56O23
EXACTMASS 964.321238098
AVERAGEMASS 964.9123400000001
SMILES OC(C1O)C(OC(=O)C)C(COC(=O)C)OC1OC(C(O)2)C(OC(C)=O)C(OC(OC(=C(c(c6)ccc(c6)OC)5)C(c(c3O5)c(cc(OC(O4)C(O)C(O)C(O)C4CO)c3CC=C(C)C)O)=O)2)C
M END
