Mol:FL7AACGL0092
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-0.8320 -0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1176 0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1176 1.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8320 1.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5466 1.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5466 0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5969 -0.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3114 0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3114 1.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5969 1.5921 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.9920 1.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6750 1.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3581 1.5725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3581 2.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6750 2.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9920 2.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6750 3.2831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9219 2.6868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1311 1.5170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8320 -0.6374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1050 -0.0534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3725 0.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8897 -0.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8182 0.0119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7522 -0.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2351 0.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3066 0.3380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3872 0.4357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9327 1.0462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9123 0.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4153 -0.0553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7636 -0.6806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0745 -1.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7442 -2.8251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6125 -2.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5748 -2.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9052 -1.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0369 -1.9966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1938 -2.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0171 -2.7119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1596 -3.2099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6065 -3.2831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3581 1.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7023 0.7949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8454 1.2402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8813 1.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5371 1.8956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3940 1.4502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9462 1.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5677 1.8527 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.9123 1.2073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.5038 0.8206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0573 0.6651 0.0000 O 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
2 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 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
15 17 1 0 0 0 0
14 18 1 0 0 0 0
5 19 1 0 0 0 0
1 20 1 0 0 0 0
8 21 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
22 28 1 0 0 0 0
27 29 1 0 0 0 0
26 30 1 0 0 0 0
25 31 1 0 0 0 0
21 23 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
37 32 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
19 46 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
M CHG 1 10 1
S SKP 5
ID FL7AACGL0092
FORMULA C33H41O20
EXACTMASS 757.219118752
AVERAGEMASS 757.6666399999999
SMILES c(c(OC(O5)C(C(O)C(C5COC(C6O)OC(C(O)C(O)6)C)O)O)3)c(c([o+1]c3c(c4)ccc(O)c4O)1)c(cc(OC(O2)C(C(C(C(CO)2)O)O)O)c1)O
M END
