Mol:FL7AAGGL0062
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
65 71 0 0 0 0 0 0 0 0999 V2000
-0.3696 2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3696 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3448 1.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0593 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0593 2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3448 2.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7738 1.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4881 1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4881 2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7738 2.8000 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
3.2647 2.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9792 2.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6936 2.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6936 3.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9792 4.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2648 3.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3338 4.0305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3467 1.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9496 2.7224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2126 0.3991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9791 4.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3586 2.4519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9255 -1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6421 -1.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4364 -0.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6669 0.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9503 -0.0158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1557 -0.8151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5732 -1.1536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1588 -2.2480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6742 -1.9389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0306 0.1172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3547 -2.1440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7660 -2.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4959 -2.3957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8059 -3.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5249 -4.1693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2329 -3.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2218 -2.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9308 -2.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6506 -2.9040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6616 -3.7288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9529 -4.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3586 -2.4825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7177 -2.2777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0576 -1.9952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0098 -1.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3514 -0.4305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4241 -0.7128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3568 -1.5354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0199 -1.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1264 -2.4282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5721 -2.9416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1297 -2.6409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8538 -1.0133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9917 -3.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2053 -4.5781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6059 -3.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3183 -3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1050 -2.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7041 -3.3643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7693 -3.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7645 -4.6635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5096 -4.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5012 -4.3395 0.0000 C 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
14 17 1 0 0 0 0
8 18 1 0 0 0 0
1 19 1 0 0 0 0
3 20 1 0 0 0 0
15 21 1 0 0 0 0
13 22 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 28 1 0 0 0 0
28 23 1 0 0 0 0
28 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
25 32 1 0 0 0 0
26 18 1 0 0 0 0
34 35 2 0 0 0 0
34 36 1 0 0 0 0
36 37 2 0 0 0 0
37 38 1 0 0 0 0
38 39 2 0 0 0 0
39 40 1 0 0 0 0
40 41 2 0 0 0 0
41 42 1 0 0 0 0
42 43 2 0 0 0 0
43 38 1 0 0 0 0
41 44 1 0 0 0 0
33 29 1 0 0 0 0
45 46 1 1 0 0 0
46 47 1 1 0 0 0
48 47 1 1 0 0 0
48 49 1 0 0 0 0
49 50 1 0 0 0 0
50 45 1 0 0 0 0
50 51 1 0 0 0 0
51 52 1 0 0 0 0
45 53 1 0 0 0 0
46 54 1 0 0 0 0
47 55 1 0 0 0 0
48 20 1 0 0 0 0
34 52 1 0 0 0 0
56 57 1 0 0 0 0
57 58 1 1 0 0 0
59 58 1 1 0 0 0
60 59 1 1 0 0 0
60 61 1 0 0 0 0
61 56 1 0 0 0 0
59 62 1 0 0 0 0
58 63 1 0 0 0 0
57 64 1 0 0 0 0
56 65 1 0 0 0 0
60 33 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AAGGL0062
FORMULA C42H47O23
EXACTMASS 919.25081281
AVERAGEMASS 919.8087800000001
SMILES O(C(Oc(c3)c(c5)c([o+1]c(c5OC(O6)C(C(C(O)C6COC(O7)C(C(C(O)C7C)O)O)O)O)c(c4)cc(c(c4O)O)O)cc3O)1)C(COC(=O)C=Cc(c2)ccc(O)c2)C(O)C(O)C1O
M END
