Mol:FL7AACGL0087
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
69 75 0 0 0 0 0 0 0 0999 V2000
-2.2030 2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2030 2.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4895 1.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7772 2.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7772 2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4895 3.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0636 1.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6485 2.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6485 2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0636 3.2771 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.3635 3.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0783 2.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7919 3.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7919 4.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0783 4.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3635 4.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9179 3.2771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3635 1.6285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5501 0.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4961 0.7177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1406 -1.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4500 -0.3689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5553 -1.5558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5027 0.2493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2407 -0.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9087 -0.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8053 -0.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7634 -0.2399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0828 -1.8844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3257 -0.7197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0783 5.3380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5069 4.5130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0052 0.4323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4683 -0.4036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1640 0.4609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0780 0.1837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9037 -0.2592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9722 -0.7872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1095 -0.2562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5542 -0.1253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6237 -0.3728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0077 -0.3058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3216 -1.4526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9045 -2.0355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9045 -2.8603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6195 -3.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6195 -4.0991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9045 -4.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1911 -4.0991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1911 -3.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9045 -5.3380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4895 0.8009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.1095 1.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7389 1.3546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2759 0.5188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5801 1.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6661 1.1050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9000 0.6617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7100 0.1763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0811 1.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1899 0.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1192 0.5496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6452 2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1140 2.7381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9389 2.7381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7016 3.4531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1140 4.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7016 4.8830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9389 4.1680 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
1 6 1 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
5 10 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
11 16 1 0 0 0 0
1 17 1 0 0 0 0
8 18 1 0 0 0 0
19 20 1 0 0 0 0
20 26 1 1 0 0 0
21 27 1 1 0 0 0
21 22 1 0 0 0 0
19 22 1 0 0 0 0
23 27 1 0 0 0 0
24 26 1 0 0 0 0
22 25 1 0 0 0 0
26 27 1 1 0 0 0
25 28 1 0 0 0 0
18 20 1 0 0 0 0
21 29 1 0 0 0 0
28 30 1 0 0 0 0
15 31 1 0 0 0 0
14 32 1 0 0 0 0
33 34 1 0 0 0 0
34 40 1 1 0 0 0
35 41 1 1 0 0 0
35 36 1 0 0 0 0
33 36 1 0 0 0 0
37 41 1 0 0 0 0
38 40 1 0 0 0 0
34 39 1 0 0 0 0
40 41 1 1 0 0 0
24 35 1 0 0 0 0
30 42 2 0 0 0 0
30 43 1 0 0 0 0
43 44 2 0 0 0 0
44 45 1 0 0 0 0
45 46 2 0 0 0 0
46 47 1 0 0 0 0
47 48 2 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
45 50 1 0 0 0 0
48 51 1 0 0 0 0
3 52 1 0 0 0 0
54 55 1 0 0 0 0
55 61 1 1 0 0 0
56 62 1 1 0 0 0
56 57 1 0 0 0 0
54 57 1 0 0 0 0
53 56 1 0 0 0 0
58 62 1 0 0 0 0
59 61 1 0 0 0 0
57 60 1 0 0 0 0
61 62 1 1 0 0 0
60 63 1 0 0 0 0
52 55 1 0 0 0 0
63 64 1 0 0 0 0
64 65 2 0 0 0 0
64 66 1 0 0 0 0
66 67 1 0 0 0 0
67 68 1 0 0 0 0
67 69 2 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AACGL0087
FORMULA C44H47O25
EXACTMASS 975.2406420539999
AVERAGEMASS 975.8289800000001
SMILES C(C2OC(O7)C(C(O)C(O)C7)O)(O)C(C(OC2Oc(c(c(c6)cc(c(O)c6)O)3)cc(c4OC(O5)C(C(O)C(O)C5COC(CC(O)=O)=O)O)c(cc(c4)O)[o+1]3)COC(C=Cc(c1)ccc(O)c1)=O)O
M END
