Mol:FL7AACGL0120
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
128139 0 0 0 0 0 0 0 0999 V2000
-1.6429 3.6987 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6429 4.5237 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3574 3.2862 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1139 3.0180 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0313 0.7182 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9285 4.9362 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3574 4.9362 -2.4048 O 0 3 0 0 0 6 0 0 0 0 0 0
-3.0719 3.6987 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1139 2.1930 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7458 0.3058 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9285 5.7612 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2139 4.5237 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0719 4.5237 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7863 3.2862 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8284 1.7805 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3994 1.7805 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7458 -0.5193 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4603 0.7183 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2139 6.1737 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5006 4.9362 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7863 4.9362 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7863 2.4611 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5009 3.6987 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8284 0.9555 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4603 -0.9318 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3027 -0.7750 -2.4048 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5006 5.7612 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2139 6.9987 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5009 4.5237 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5428 0.5429 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4603 -1.7568 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9033 -0.6760 -2.4048 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2150 6.1737 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2153 4.9362 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5428 -0.2820 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2573 0.9555 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1748 -2.1693 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7458 -2.1693 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2573 -0.6945 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9719 0.5429 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1748 -2.9943 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7458 -2.9943 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9719 -0.2820 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2573 -1.5196 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4603 -3.4068 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4529 4.0007 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6863 -0.6945 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4603 -4.2318 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9012 3.2867 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9012 4.1117 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6157 4.5242 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1868 4.5242 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6157 5.3492 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3302 5.7617 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3302 6.5868 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0446 5.3492 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0446 6.9993 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7592 5.7617 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7592 6.5868 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0446 7.8243 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4736 6.9993 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.1674 4.4132 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8818 4.0007 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5963 4.4132 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.3108 4.0007 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.1674 5.2382 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.5963 5.2382 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.5560 2.8495 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1435 2.1351 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3454 2.3442 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5522 2.1351 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9646 2.8495 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7627 2.6405 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7620 1.7608 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.3529 2.6360 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9685 2.1351 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.4702 3.3063 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7974 -7.0274 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0830 -6.6149 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2921 -5.8168 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0830 -5.0236 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7974 -5.4360 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5884 -6.2341 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7087 -5.2334 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5839 -7.8243 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0830 -7.4399 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3029 -6.6466 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5164 -7.4435 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6705 3.1454 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1679 0.7526 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3430 0.7527 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1250 1.5484 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5473 2.1308 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3722 2.1308 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5902 1.3351 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3280 1.7619 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3814 -0.0443 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7555 0.0382 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4153 1.3352 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5224 0.9787 2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2504 0.9787 2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3049 0.4415 2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4949 -0.3122 2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2677 -0.3123 2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7123 0.2251 2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3242 0.2251 2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4804 -1.1061 2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9245 0.1125 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2914 1.8876 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6222 2.2739 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8345 1.5311 -1.9751 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6222 0.7834 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2914 0.3969 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0791 1.1400 -1.9751 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2727 2.6485 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6090 0.8340 -1.9751 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3676 -0.6372 -1.9751 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2221 4.2734 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9365 4.6859 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7274 5.4840 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9365 6.2772 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2221 5.8648 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4311 5.0667 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3108 6.0674 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
8.4356 3.4765 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9365 3.8609 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7166 4.6542 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5031 3.8573 -2.4048 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
1 3 2 0
2 6 1 0
2 7 2 0
3 8 1 0
4 9 2 0
5 10 1 0
6 11 1 0
6 12 2 0
7 13 1 0
8 13 2 0
8 14 1 0
9 15 1 0
9 16 1 0
10 17 1 0
10 18 2 0
11 19 2 0
12 20 1 0
13 21 1 0
14 22 1 0
14 23 2 0
15 24 2 0
17 25 2 0
17 26 1 0
19 27 1 0
19 28 1 0
20 27 2 0
21 29 2 0
23 29 1 0
24 30 1 0
25 31 1 0
25 32 1 0
27 33 1 0
29 34 1 0
30 35 1 0
30 36 2 0
31 37 1 0
31 38 2 0
35 39 2 0
36 40 1 0
37 41 2 0
38 42 1 0
39 43 1 0
39 44 1 0
40 43 2 0
41 45 1 0
42 45 2 0
43 47 1 0
45 48 1 0
49 50 1 0
50 51 1 0
50 52 2 0
51 53 2 0
53 54 1 0
54 55 1 0
54 56 2 0
55 57 2 0
56 58 1 0
57 59 1 0
57 60 1 0
58 59 2 0
59 61 1 0
46 62 1 0
62 63 1 0
63 64 1 0
64 65 1 0
62 66 2 0
64 67 2 0
68 69 1 1
70 69 1 1
71 70 1 1
71 72 1 0
72 73 1 0
73 68 1 0
70 74 1 0
68 75 1 0
69 76 1 0
73 77 1 0
46 77 1 0
22 71 1 0
78 79 1 1
80 79 1 1
81 80 1 1
81 82 1 0
82 83 1 0
83 78 1 0
80 84 1 0
78 85 1 0
79 86 1 0
83 87 1 0
87 88 1 0
48 81 1 0
90 91 1 1
92 91 1 1
93 92 1 1
93 94 1 0
94 95 1 0
95 90 1 0
93 89 1 0
92 96 1 0
90 97 1 0
91 98 1 0
95 99 1 0
100101 1 0
101102 1 1
102103 1 1
104103 1 1
104105 1 0
105100 1 0
105106 1 0
104107 1 0
96101 1 0
5 99 1 0
89 1 1 0
16100 1 0
109110 1 0
110111 1 1
111112 1 1
113112 1 1
113114 1 0
114109 1 0
109115 1 0
114116 1 0
113117 1 0
112108 1 0
108 47 1 0
49110 1 0
118119 1 1
120119 1 1
121120 1 1
121122 1 0
122123 1 0
123118 1 0
120124 1 0
118125 1 0
119126 1 0
123127 1 0
127128 1 0
61121 1 0
M CHG 1 7 1
S SKP 9
AUTODRAW FALSE
ID FL7AACGL0120
KNApSAcK_ID
NAME OVA 1
CAS_RN 865377-14-6
FORMULA C80H89O46
EXACTMASS 1785.46250046
AVERAGEMASS 1786.5350600000002
SMILES OC(C(Oc(c2)c(c4)c([o+1]c(c4OC(C(OC(C(OC(C=Cc(c%12)ccc(c%12O)OCC(O9)C(C(O)C(C9OC(C=Cc(c%11)ccc(c%11O)OC(O%10)C(C(C(O)C%10CO)O)O)=O)O)O)=O)8)OCC(C8O)O)5)OC(COC(C(=C(c(c6)ccc(OC(C7O)OC(CO)C(C7O)O)c6)[H])[H])=O)C(O)C5O)c(c3)cc(O)c(O)c3)cc2O)1)C(C(C(COC(CC(O)=O)=O)O1)O)O
M END
