Mol:FL7AACGL0110
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
45 49 0 0 0 0 0 0 0 0999 V2000
-2.1643 2.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1643 1.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4498 1.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7353 1.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7353 2.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4498 2.8534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0209 1.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6936 1.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6936 2.4409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0209 2.8534 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.4701 2.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1846 2.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8991 2.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8991 3.7142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1846 4.1267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4701 3.7142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5393 4.0838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3378 1.2441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7442 2.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4498 0.4407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5591 2.5081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4526 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3712 -0.8727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6354 -0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2613 0.4471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4375 0.4956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1730 -0.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5335 -0.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5403 -1.5155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0287 -1.3538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4947 -0.0430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1223 -0.7223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6103 -1.4220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0229 -2.1367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2294 -1.9099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4311 -2.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0184 -1.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8119 -1.6312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4165 -2.8363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7867 -2.5751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5591 -1.9259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3448 -1.5049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4165 -3.6632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0646 -4.1267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7219 -4.1251 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 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 5 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
8 18 1 0 0 0 0
1 19 1 0 0 0 0
3 20 1 0 0 0 0
13 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
22 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
25 18 1 0 0 0 0
28 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
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
39 43 1 0 0 0 0
43 44 2 0 0 0 0
43 45 1 0 0 0 0
37 32 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AACGL0110
FORMULA C29H33O16
EXACTMASS 637.176860008
AVERAGEMASS 637.56272
SMILES c(c1c(c3OC(C(O)5)OC(C(O)C5O)COC(C4OC(C)=O)OC(C)C(O)C(O)4)[o+1]c(c(c3)2)cc(cc(O)2)O)cc(c(c1)O)O
M END
