Mol:FL5FCCGS0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
54 59 0 0 0 0 0 0 0 0999 V2000
-2.8765 1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8765 0.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1753 0.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4741 0.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4741 1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1753 1.9927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7728 0.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0716 0.7782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0716 1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7728 1.9927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7728 -0.2579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6293 1.9926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3440 1.5800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0587 1.9926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0587 2.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3440 3.2304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6293 2.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6123 0.3279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1753 -0.4360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4809 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0577 -1.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8714 -1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6901 -1.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1134 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2996 -1.0598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6973 -0.9215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5778 0.8977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1546 0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9683 0.3973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7870 0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2102 0.8977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3965 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8356 0.7843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8154 1.1616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5243 0.3270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0422 -0.0755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5290 -1.3593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3808 -1.8994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6901 -2.2743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8578 3.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3440 4.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8617 -2.6085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4386 -3.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2522 -3.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0709 -3.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4942 -2.6085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6804 -2.8409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2019 -2.7028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1505 -3.1213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7204 -3.7836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0709 -4.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2023 1.5541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4832 1.9381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1134 3.0298 0.0000 C 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
8 18 1 0 0 0 0
3 19 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 1 0 0 0
22 23 1 1 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 20 1 0 0 0 0
20 26 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 1 0 0 0
29 30 1 1 0 0 0
31 30 1 1 0 0 0
31 32 1 0 0 0 0
32 27 1 0 0 0 0
27 33 1 0 0 0 0
32 34 1 0 0 0 0
30 35 1 0 0 0 0
24 36 1 0 0 0 0
35 36 1 0 0 0 0
21 37 1 0 0 0 0
22 38 1 0 0 0 0
23 39 1 0 0 0 0
28 18 1 0 0 0 0
40 15 1 0 0 0 0
16 41 1 0 0 0 0
42 43 1 0 0 0 0
43 44 1 1 0 0 0
44 45 1 1 0 0 0
46 45 1 1 0 0 0
46 47 1 0 0 0 0
47 42 1 0 0 0 0
42 48 1 0 0 0 0
43 49 1 0 0 0 0
44 50 1 0 0 0 0
45 51 1 0 0 0 0
46 38 1 0 0 0 0
31 52 1 0 0 0 0
53 54 1 0 0 0 0
1 53 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 53 54
M SBL 1 1 59
M SMT 1 ^ OCH3
M SBV 1 59 0.6067 -0.3503
S SKP 5
ID FL5FCCGS0007
FORMULA C34H42O20
EXACTMASS 770.226943784
AVERAGEMASS 770.6852799999999
SMILES C(C(O)1)(O)C(O)C(OC(=C5c(c6)ccc(O)c(O)6)C(=O)c(c(O5)4)c(O)cc(OC)c4)OC1COC(O3)C(O)C(C(C3C)O)OC(C2O)OC(C(O)C2O)C
M END
