Mol:FL5FAAGS0093
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
2.7957 3.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7957 2.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5102 1.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2246 2.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2246 3.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5102 3.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0813 1.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3669 2.1968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6524 1.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6524 0.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3669 0.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0813 0.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0621 2.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7765 1.7843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7765 0.9593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0621 0.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3669 -0.1714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4909 2.1968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8540 0.5460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8254 3.3685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0621 -0.1527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2404 2.7628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8278 2.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0295 2.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2360 2.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6486 2.7452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4470 2.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7262 2.9761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5568 3.0057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8254 2.5257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4401 2.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6221 1.6366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7698 -0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6355 -1.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2982 -0.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1190 -0.8263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2533 -0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5906 -0.5040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4165 -1.3683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0947 -1.7197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1140 -1.3982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1956 -0.9203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1338 -2.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8880 -3.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4104 -2.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1855 -2.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4314 -1.9559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9088 -2.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2736 -2.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6827 -2.8107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6576 -3.3484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1680 -3.4342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2684 -2.8436 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
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 18 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
36 39 1 0 0 0 0
35 40 1 0 0 0 0
34 41 1 0 0 0 0
33 42 1 0 0 0 0
37 19 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
48 49 1 0 0 0 0
49 50 1 0 0 0 0
43 51 1 0 0 0 0
44 52 1 0 0 0 0
45 53 1 0 0 0 0
39 46 1 0 0 0 0
S SKP 5
ID FL5FAAGS0093
FORMULA C33H40O20
EXACTMASS 756.21129372
AVERAGEMASS 756.6587
SMILES OC(C(C)5)C(O)C(OC(O6)C(C(C(O)C6CO)O)O)C(O5)OC(C(=O)3)=C(c(c4)ccc(c4)O)Oc(c31)cc(OC(C(O)2)OC(CO)C(O)C2O)cc(O)1
M END
