Mol:FL5FFCGS0024
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
43 47 0 0 0 0 0 0 0 0999 V2000
1.7861 1.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 2.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 2.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 3.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5005 2.8950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5005 2.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 1.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 2.0701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 1.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 0.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 0.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 2.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5005 1.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5005 0.8326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 0.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 -0.2869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2150 2.0701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.4201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -0.2709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2150 3.3075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 4.1325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 2.7660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4767 3.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2540 -0.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6666 -1.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1268 -1.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9251 -1.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3379 -0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5443 -0.8574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9178 -1.9812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3981 -1.6610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1437 -1.2350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0000 -0.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2367 -3.5800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4396 -3.7936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0230 -3.0812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6984 -2.6805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0987 -2.4669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5153 -3.1793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0018 -3.0812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9689 -4.0992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5557 -4.1325 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
13 23 1 0 0 0 0
23 24 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 1 0 0 0
28 27 1 1 0 0 0
29 28 1 1 0 0 0
29 30 1 0 0 0 0
30 25 1 0 0 0 0
28 31 1 0 0 0 0
27 32 1 0 0 0 0
26 33 1 0 0 0 0
25 34 1 0 0 0 0
35 36 1 1 0 0 0
36 37 1 1 0 0 0
38 37 1 1 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
40 35 1 0 0 0 0
37 41 1 0 0 0 0
36 42 1 0 0 0 0
35 43 1 0 0 0 0
38 31 1 0 0 0 0
29 19 1 0 0 0 0
S SKP 5
ID FL5FFCGS0024
FORMULA C27H30O16
EXACTMASS 610.153384912
AVERAGEMASS 610.5175
SMILES O(C(OC(C2OC(C(=O)4)=C(Oc(c5OC)c4c(O)cc5O)c(c3)ccc(c3O)O)C(O)C(C(C)O2)O)1)CC(C(O)C1O)O
M END
