Mol:FL3FABGS0016
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-0.1528 -2.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5616 -1.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5616 -1.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1528 -0.6025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8673 -1.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8673 -1.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2761 -2.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9906 -1.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9906 -1.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2761 -0.6025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7223 -0.5926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4276 -0.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1328 -0.5926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1328 0.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4276 0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7223 0.2219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7168 0.5591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5397 0.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2761 -2.9489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1528 -2.9698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5064 -0.6461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8311 2.3492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6211 1.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3899 1.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6407 0.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8506 0.5897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0816 1.4721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2042 2.9698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6215 2.4705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0536 0.5902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6065 1.8379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6145 2.5835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6382 -0.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0724 -1.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2026 -1.3374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3142 -1.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8799 -0.7422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7498 -1.0168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3484 -0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5397 -1.3324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7017 -2.0187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2845 -2.1956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9155 1.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4595 0.4226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5771 0.6537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7001 0.4030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1560 1.1931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0384 0.9620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3711 0.9605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0434 0.4981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0946 -0.0306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4028 1.4564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0440 1.4677 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 2 0 0 0 0
9 10 1 0 0 0 0
10 3 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 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 11 1 0 0 0 0
14 17 1 0 0 0 0
17 18 1 0 0 0 0
7 19 2 0 0 0 0
1 20 1 0 0 0 0
5 21 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 27 1 0 0 0 0
27 22 1 0 0 0 0
22 28 1 0 0 0 0
23 29 1 0 0 0 0
24 30 1 0 0 0 0
21 25 1 0 0 0 0
27 31 1 0 0 0 0
31 32 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
37 36 1 1 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
33 39 1 0 0 0 0
34 40 1 0 0 0 0
35 41 1 0 0 0 0
36 42 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 48 1 0 0 0 0
48 43 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
48 52 1 0 0 0 0
52 53 1 0 0 0 0
30 46 1 0 0 0 0
51 37 1 0 0 0 0
S SKP 5
ID FL3FABGS0016
FORMULA C34H42O19
EXACTMASS 754.2320291619999
AVERAGEMASS 754.68588
SMILES c(c31)c(OC(C4OC(O6)C(C(C(C6CO)O)O)OC(O5)C(O)C(O)C(C5C)O)OC(C(C4O)O)CO)cc(O)c1C(C=C(O3)c(c2)ccc(OC)c2)=O
M END
