Mol:FL5FADGS0021
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
43 47 0 0 0 0 0 0 0 0999 V2000
1.7862 1.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 1.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 2.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 2.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 2.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 1.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 1.6128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 1.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 1.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 1.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -0.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.7664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 1.6128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1968 -0.1211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 -0.7003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 2.8503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 3.6753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5104 4.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1155 -3.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1746 -4.0934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2106 -3.5200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4664 -2.9869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0484 -2.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6118 -3.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9099 -2.9990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0896 -2.7582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1095 -3.1592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2214 -1.6896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4909 -2.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0725 -1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8645 -1.2386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1340 -0.8545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4294 -1.4576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1004 -1.2743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7366 -1.6675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6593 -2.1925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1310 -2.3017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1162 -1.8570 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
6 1 1 0 0 0 0
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
12 19 1 0 0 0 0
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
22 23 1 0 0 0 0
30 24 1 1 0 0 0
29 24 1 1 0 0 0
28 30 1 1 0 0 0
24 25 1 0 0 0 0
30 26 1 0 0 0 0
31 28 1 0 0 0 0
27 32 1 0 0 0 0
29 31 1 0 0 0 0
24 27 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
33 41 1 0 0 0 0
34 42 1 0 0 0 0
35 43 1 0 0 0 0
36 19 1 0 0 0 0
43 28 1 0 0 0 0
S SKP 5
ID FL5FADGS0021
FORMULA C27H30O16
EXACTMASS 610.153384912
AVERAGEMASS 610.5175
SMILES c(c5O)c(c(C2=O)c(c5)OC(=C(OC(O4)C(C(O)C(C(CO)4)O)OC(C(O)3)OCC3(O)CO)2)c(c1)ccc(c1OC)O)O
M END
