Mol:FL7AAHGL0017
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
89 97 0 0 0 0 0 0 0 0999 V2000
-1.9143 3.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1899 4.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1899 5.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9143 5.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6386 5.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6386 4.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4655 3.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2589 4.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2589 5.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4655 5.5804 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.0252 5.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7104 5.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3956 5.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3956 6.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7104 6.7914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0252 6.3958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0153 6.7535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3148 5.5526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9143 3.3304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0854 3.9871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7104 7.4275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3248 8.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0202 5.2440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2599 2.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0549 1.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5789 2.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7245 2.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9895 3.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4655 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5100 3.4613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1497 3.4847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7268 1.5614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8650 1.0119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4806 1.1934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4473 4.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6500 3.4655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6362 3.3384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4200 2.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2173 3.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2311 3.4478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6882 4.2441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9260 3.8306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8650 2.9458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2453 2.6837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3278 1.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0065 0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7831 -0.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6174 0.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6109 0.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8345 1.2565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0001 0.7156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8280 -0.5070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3919 -0.6857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2897 0.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9296 0.0774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3186 0.7619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7680 1.5404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6108 0.7619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0716 0.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8012 0.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2012 0.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0013 0.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4013 0.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0013 -0.4700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2012 -0.4700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4162 0.2008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8966 -3.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3010 -2.2074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9118 -1.4226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0374 -0.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6329 -1.2325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0223 -2.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6346 -0.5046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4300 -3.6228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2378 -3.1490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4508 -3.0479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0503 -3.9760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4821 -4.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9881 -5.3824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7279 -4.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2513 -5.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6829 -6.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5079 -6.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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-3.5623 -6.7923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8168 -8.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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3 4 2 0 0 0 0
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5 6 2 0 0 0 0
6 1 1 0 0 0 0
2 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 3 1 0 0 0 0
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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
14 17 1 0 0 0 0
5 18 1 0 0 0 0
1 19 1 0 0 0 0
8 20 1 0 0 0 0
15 21 1 0 0 0 0
21 22 1 0 0 0 0
13 23 1 0 0 0 0
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27 26 1 1 0 0 0
28 27 1 1 0 0 0
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30 31 1 0 0 0 0
24 32 1 0 0 0 0
25 33 1 0 0 0 0
26 34 1 0 0 0 0
19 27 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 1 0 0 0
38 37 1 1 0 0 0
39 38 1 1 0 0 0
39 40 1 0 0 0 0
40 35 1 0 0 0 0
20 36 1 0 0 0 0
35 41 1 0 0 0 0
40 42 1 0 0 0 0
39 43 1 0 0 0 0
38 44 1 0 0 0 0
44 45 1 0 0 0 0
46 47 1 0 0 0 0
47 48 1 1 0 0 0
49 48 1 1 0 0 0
50 49 1 1 0 0 0
50 51 1 0 0 0 0
51 46 1 0 0 0 0
45 50 1 0 0 0 0
49 52 1 0 0 0 0
48 53 1 0 0 0 0
46 54 1 0 0 0 0
47 55 1 0 0 0 0
55 56 1 0 0 0 0
56 57 2 0 0 0 0
56 58 1 0 0 0 0
58 59 2 0 0 0 0
59 60 1 0 0 0 0
60 61 2 0 0 0 0
61 62 1 0 0 0 0
62 63 2 0 0 0 0
63 64 1 0 0 0 0
64 65 2 0 0 0 0
65 60 1 0 0 0 0
63 66 1 0 0 0 0
67 68 1 1 0 0 0
68 69 1 1 0 0 0
70 69 1 1 0 0 0
70 71 1 0 0 0 0
71 72 1 0 0 0 0
72 67 1 0 0 0 0
69 73 1 0 0 0 0
67 74 1 0 0 0 0
68 75 1 0 0 0 0
66 70 1 0 0 0 0
72 76 1 0 0 0 0
76 77 1 0 0 0 0
77 78 1 0 0 0 0
78 79 2 0 0 0 0
78 80 1 0 0 0 0
80 81 2 0 0 0 0
81 82 1 0 0 0 0
82 83 2 0 0 0 0
83 84 1 0 0 0 0
84 85 2 0 0 0 0
85 86 1 0 0 0 0
86 87 2 0 0 0 0
87 82 1 0 0 0 0
84 88 1 0 0 0 0
85 89 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AAHGL0017
FORMULA C58H65O31
EXACTMASS 1257.350980362
AVERAGEMASS 1258.1181000000001
SMILES c(c(O)1)(ccc(C=CC(OCC(O2)C(O)C(O)C(C2Oc(c3)ccc(C=CC(=O)OC(C4C)C(O)C(O)C(OCC(C(O)9)OC(C(O)C9O)Oc(c7c(c8)cc(c(c(OC)8)O)O)cc(c([o+1]7)5)c(OC(O6)C(C(C(O)C6CO)O)O)cc(O)c5)O4)c3)O)=O)c1)O
M END
