Mol:FL5FFANI0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
33 35 0 0 0 0 0 0 0 0999 V2000
-3.0915 0.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0915 -0.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5352 -0.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9789 -0.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9789 0.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5352 0.6494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4226 -0.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8663 -0.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8663 0.3283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4226 0.6494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4226 -1.1361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3102 0.6493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2568 0.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8238 0.6493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8238 1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2568 1.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3102 1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6483 0.6789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2865 -0.6205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5352 -1.2774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3906 1.6313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9562 1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5207 1.6306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0851 1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6483 1.6299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0851 0.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2986 -0.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8833 -0.6207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4668 -0.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0503 -0.6207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4668 -1.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2571 1.2225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8205 2.1222 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 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
18 1 1 0 0 0 0
8 19 1 0 0 0 0
3 20 1 0 0 0 0
15 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 2 0 0 0 0
24 25 1 0 0 0 0
24 26 1 0 0 0 0
19 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 2 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
6 32 1 0 0 0 0
32 33 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 32 33
M SBL 1 1 34
M SMT 1 OCH3
M SVB 1 34 -2.2571 1.2225
S SKP 8
ID FL5FFANI0003
KNApSAcK_ID C00005007
NAME 5,7-Dihydroxy-8-methoxy-3,4'-diprenyloxyflavone
CAS_RN 160036-22-6
FORMULA C26H28O7
EXACTMASS 452.18350325
AVERAGEMASS 452.49631999999997
SMILES c(c3)(ccc(OCC=C(C)C)c3)C(O2)=C(OCC=C(C)C)C(c(c21)c(cc(O)c1OC)O)=O
M END
