Mol:FL2FA9NI0011
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
30 32 0 0 0 0 0 0 0 0999 V2000
-0.2828 -0.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2828 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 -1.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8299 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8299 -0.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3862 -1.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9425 -1.0555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9425 -0.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3862 -0.0920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4986 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0655 -0.4194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6325 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6325 0.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0655 0.8900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4986 0.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3862 -1.9205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8388 -0.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5379 0.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2369 -0.0920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9347 0.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6325 -0.0918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9346 1.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 0.6269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2668 0.9389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2668 1.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8125 1.9497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2479 1.9319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1629 -1.5372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5516 -1.9497 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 1 0 0 0 0
9 10 1 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
7 17 2 0 0 0 0
1 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
6 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
26 28 1 0 0 0 0
3 29 1 0 0 0 0
29 30 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 29 30
M SBL 1 1 31
M SMT 1 OCH3
M SBV 1 31 -7.1294 5.2838
S SKP 8
ID FL2FA9NI0011
KNApSAcK_ID C00008184
NAME 5-Methoxy-7-prenyloxy-8-C-prenylflavanone
CAS_RN -
FORMULA C26H30O4
EXACTMASS 406.21440944799997
AVERAGEMASS 406.51399999999995
SMILES CC(C)=CCc(c(OCC=C(C)C)3)c(c(c(OC)c3)1)OC(c(c2)cccc2)CC(=O)1
M END
