Mol:FL5FACGL0023
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-3.0656 1.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0656 1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3644 0.7310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6632 1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6632 1.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3644 2.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9620 0.7310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2608 1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2608 1.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9620 2.3504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9481 -0.0206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4402 2.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1549 1.9377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8695 2.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8695 3.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1549 3.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4402 3.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7666 2.3503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4644 0.6856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3644 -0.0783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0647 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6416 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4554 -1.2587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2741 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6973 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8834 -0.9908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2788 -0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5122 1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0891 0.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9029 0.7137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7216 0.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1449 1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3309 0.9816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7691 1.0846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6661 1.5620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7666 1.0461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4258 0.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6276 -0.0286 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1139 -1.3498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9648 -1.8923 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2741 -2.2053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6686 3.6369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1549 4.4132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8263 -2.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4032 -3.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2169 -3.4666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0355 -3.6991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4588 -2.9662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6450 -3.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0404 -3.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8754 -3.5577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7676 -4.0383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0355 -4.4132 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
8 19 1 0 0 0 0
3 20 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
21 27 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 1 0 0 0
30 31 1 1 0 0 0
32 31 1 1 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
28 34 1 0 0 0 0
33 35 1 0 0 0 0
32 36 1 0 0 0 0
31 37 1 0 0 0 0
25 38 1 0 0 0 0
37 38 1 0 0 0 0
22 39 1 0 0 0 0
23 40 1 0 0 0 0
24 41 1 0 0 0 0
29 19 1 0 0 0 0
42 15 1 0 0 0 0
16 43 1 0 0 0 0
44 45 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 44 1 0 0 0 0
44 50 1 0 0 0 0
45 51 1 0 0 0 0
46 52 1 0 0 0 0
47 53 1 0 0 0 0
48 41 1 0 0 0 0
S SKP 5
ID FL5FACGL0023
FORMULA C33H40O20
EXACTMASS 756.21129372
AVERAGEMASS 756.6587
SMILES c(c51)(OC(c(c6)ccc(O)c6O)=C(C5=O)OC(O2)C(C(C(O)C2COC(O3)C(OC(C4O)OC(C(C4O)O)C)C(O)C(C(C)3)O)O)O)cc(cc(O)1)O
M END
