Mol:FL7AACGL0019
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
-2.2733 0.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2733 -0.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5588 -0.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8443 -0.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8443 0.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5588 1.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1299 -0.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5846 -0.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5846 0.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1299 1.1005 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.2988 1.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0270 0.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7551 1.1004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7551 1.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0270 2.3616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2988 1.9412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5588 -1.3741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0270 3.2022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9875 1.1004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4831 2.3615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5025 -1.3739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9064 -2.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0481 -1.8267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2201 -1.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8218 -1.2160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5727 -1.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1539 -1.6480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7090 -2.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2869 -2.3236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7533 -1.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3902 -2.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0883 -2.3886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7909 -2.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1539 -1.9594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4558 -2.1588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0894 -2.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6730 -0.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2288 -0.7804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0892 -0.4632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7917 -0.6626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1548 -0.0338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4565 -0.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7442 -0.2651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0444 0.3794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9904 -0.1697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5205 -0.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9568 -1.1640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6769 -2.4227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6605 -3.0546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7922 -3.2022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3714 -0.6177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2549 -0.9761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7665 0.0715 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
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
3 17 1 0 0 0 0
15 18 1 0 0 0 0
1 19 1 0 0 0 0
14 20 1 0 0 0 0
21 22 1 1 0 0 0
22 23 1 1 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
21 27 1 0 0 0 0
22 28 1 0 0 0 0
23 29 1 0 0 0 0
24 17 1 0 0 0 0
30 31 1 0 0 0 0
31 32 1 1 0 0 0
32 33 1 1 0 0 0
34 33 1 1 0 0 0
34 35 1 0 0 0 0
35 30 1 0 0 0 0
30 36 1 0 0 0 0
37 38 1 0 0 0 0
38 39 1 1 0 0 0
39 40 1 1 0 0 0
41 40 1 1 0 0 0
41 42 1 0 0 0 0
42 37 1 0 0 0 0
37 43 1 0 0 0 0
42 44 1 0 0 0 0
41 45 1 0 0 0 0
40 46 1 0 0 0 0
34 47 1 0 0 0 0
46 47 1 0 0 0 0
31 48 1 0 0 0 0
32 49 1 0 0 0 0
33 50 1 0 0 0 0
51 38 1 0 0 0 0
8 51 1 0 0 0 0
52 53 1 0 0 0 0
26 52 1 0 0 0 0
M CHG 1 10 1
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 52 53
M SBL 1 1 58
M SMT 1 ^ CH2OH
M SBV 1 58 0.6823 -0.6361
S SKP 5
ID FL7AACGL0019
FORMULA C33H41O20
EXACTMASS 757.219118752
AVERAGEMASS 757.6666399999999
SMILES c(c1)(O)c(cc(c([o+1]6)c(cc(c64)c(OC(O5)C(C(C(O)C(CO)5)O)O)cc(O)c4)OC(O2)C(C(O)C(O)C2COC(C3O)OC(C(O)C(O)3)C)O)c1)O
M END
