Mol:FL7AACGL0089
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
80 87 0 0 0 0 0 0 0 0999 V2000
-2.0903 3.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0903 2.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3768 2.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6645 2.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6645 3.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3768 3.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0490 2.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7612 2.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7612 3.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0490 3.6502 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.4761 3.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1911 3.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9046 3.6502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9046 4.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1911 4.8861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4761 4.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8053 3.6502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4761 2.0016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7659 0.8960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7118 1.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0752 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6658 -0.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8330 -1.2444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7184 0.5605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0164 -0.3668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1245 0.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0211 -0.6814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5696 0.0934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0917 -1.4906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2144 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1911 5.7111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6195 4.8861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2416 0.8674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7046 0.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4004 0.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3144 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2637 0.0932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2705 -0.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4504 0.2806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7907 0.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8601 0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8744 0.0467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1883 -1.2031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7713 -1.7860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7713 -2.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4861 -3.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4861 -3.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7713 -4.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0577 -3.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0577 -3.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7713 -5.0886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.4504 -4.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0592 -4.4915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5961 -5.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9004 -4.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9864 -4.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1186 -5.1418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0510 -5.7111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4219 -4.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5102 -5.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4396 -5.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2460 -3.7466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3768 1.1740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9349 1.6553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5437 1.8309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0806 0.9950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3849 1.8617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4708 1.5812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6016 1.1380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5973 0.7351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9683 2.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9946 1.2732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9241 1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5325 2.5943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9395 3.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7643 3.1318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5270 3.8467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9395 4.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5270 5.2767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7643 4.5617 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
53 54 1 0 0 0 0
54 60 1 1 0 0 0
55 61 1 1 0 0 0
55 56 1 0 0 0 0
53 56 1 0 0 0 0
52 55 1 0 0 0 0
57 61 1 0 0 0 0
58 60 1 0 0 0 0
56 59 1 0 0 0 0
60 61 1 1 0 0 0
59 62 1 0 0 0 0
51 54 1 0 0 0 0
3 63 1 0 0 0 0
65 66 1 0 0 0 0
66 72 1 1 0 0 0
67 73 1 1 0 0 0
67 68 1 0 0 0 0
65 68 1 0 0 0 0
64 67 1 0 0 0 0
69 73 1 0 0 0 0
70 72 1 0 0 0 0
68 71 1 0 0 0 0
72 73 1 1 0 0 0
71 74 1 0 0 0 0
63 66 1 0 0 0 0
74 75 1 0 0 0 0
75 76 2 0 0 0 0
75 77 1 0 0 0 0
77 78 1 0 0 0 0
78 79 1 0 0 0 0
78 80 2 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AACGL0089
FORMULA C50H57O30
EXACTMASS 1137.293465484
AVERAGEMASS 1137.96958
SMILES C(C1O)(COC(=O)CC(O)=O)OC(Oc(c82)cc(cc2[o+1]c(c(c8)OC(C(OC(C(O)7)OCC(O)C(O)7)4)OC(COC(C=Cc(c5)ccc(OC(O6)C(O)C(O)C(C(CO)6)O)c5)=O)C(O)C(O)4)c(c3)cc(O)c(O)c3)O)C(O)C1O
M END
