Mol:FL5FAAGL0046
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
52 57 0 0 0 0 0 0 0 0999 V2000
-1.8790 0.9346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8790 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1778 -0.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4766 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4766 0.9346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1778 1.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2246 -0.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9258 0.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9258 0.9346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2246 1.3394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2246 -0.9113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6268 1.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3414 0.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0560 1.3392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0560 2.1644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3414 2.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6268 2.1644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5799 1.3392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7705 2.5770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6082 -0.3035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1778 -1.0894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5194 -1.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0963 -2.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9100 -2.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7286 -2.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1519 -1.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3381 -1.8161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7335 -1.7943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6782 0.3268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2550 -0.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0688 -0.1735 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8874 -0.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3106 0.3268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4969 0.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0174 0.2386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9378 0.6513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0542 0.1604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6441 -0.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0190 -0.8525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5685 -2.1752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4401 -2.7588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7286 -3.0306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1543 0.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2400 0.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8972 1.5584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1218 2.4501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0363 2.4502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3791 1.8143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0143 2.9596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4479 3.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1519 2.0140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6839 0.5760 0.0000 O 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 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
1 18 1 0 0 0 0
15 19 1 0 0 0 0
8 20 1 0 0 0 0
3 21 1 0 0 0 0
22 23 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 22 1 0 0 0 0
22 28 1 0 0 0 0
29 30 1 0 0 0 0
30 31 1 1 0 0 0
31 32 1 1 0 0 0
33 32 1 1 0 0 0
33 34 1 0 0 0 0
34 29 1 0 0 0 0
29 35 1 0 0 0 0
34 36 1 0 0 0 0
33 37 1 0 0 0 0
32 38 1 0 0 0 0
26 39 1 0 0 0 0
38 39 1 0 0 0 0
23 40 1 0 0 0 0
24 41 1 0 0 0 0
25 42 1 0 0 0 0
30 20 1 0 0 0 0
44 43 1 1 0 0 0
44 45 1 0 0 0 0
45 46 1 0 0 0 0
46 47 1 0 0 0 0
47 48 1 1 0 0 0
48 43 1 1 0 0 0
47 49 1 0 0 0 0
46 50 1 0 0 0 0
48 51 1 0 0 0 0
43 52 1 0 0 0 0
44 18 1 0 0 0 0
S SKP 5
ID FL5FAAGL0046
FORMULA C33H40O19
EXACTMASS 740.216379098
AVERAGEMASS 740.6593
SMILES O(C(OC(C(=O)3)=C(c(c6)ccc(c6)O)Oc(c4)c3c(cc(OC(C5O)OC(C)C(C5O)O)4)O)1)C(COC(O2)C(C(C(O)C2C)O)O)C(O)C(C(O)1)O
M END
