Mol:FL5FAAGS0084
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
1.1287 3.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1287 2.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8431 2.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5576 2.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5576 3.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8431 4.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4142 2.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3004 2.9890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0149 2.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0149 1.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3004 1.3390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4142 1.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7293 2.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4438 2.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4438 1.7515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7293 1.3390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3004 0.6207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1583 2.9890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0205 1.4014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1583 4.1608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7293 0.6395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5956 -0.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2291 -0.8588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4253 -0.0575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0026 0.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1778 0.5096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0185 -0.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6068 -0.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9963 -0.8546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7515 -1.5361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1682 -1.3596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2995 0.1044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5957 -3.5777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7718 -3.6197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5136 -2.8361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8921 -2.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7161 -2.2514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9744 -3.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5499 -3.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9166 -3.4966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7814 -4.2265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2522 -4.0838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5940 -2.7104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2550 -1.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7221 -2.3102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8592 -1.4966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3917 -0.8665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9246 -0.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7875 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9970 -1.1656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2885 -2.2878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3559 -2.6272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0029 -2.2493 0.0000 C 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
5 20 1 0 0 0 0
16 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
27 28 1 0 0 0 0
28 29 1 0 0 0 0
22 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 19 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
44 45 1 0 0 0 0
45 46 1 1 0 0 0
47 46 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
47 50 1 0 0 0 0
46 51 1 0 0 0 0
45 52 1 0 0 0 0
44 53 1 0 0 0 0
48 32 1 0 0 0 0
36 30 1 0 0 0 0
S SKP 5
ID FL5FAAGS0084
FORMULA C33H40O20
EXACTMASS 756.21129372
AVERAGEMASS 756.6587
SMILES OCC(C1OC(C(O)6)OC(CO)C(O)C6O)OC(OC(C4=O)=C(c(c5)ccc(O)c5)Oc(c43)cc(O)cc3O)C(OC(C(O)2)OC(C)C(O)C2O)C1O
M END
