Mol:FL2FA9NI0010
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 27 0 0 0 0 0 0 0 0999 V2000
-0.2828 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2828 -0.6390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 -0.9602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8299 -0.6390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8299 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2736 0.3245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3862 -0.9602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9425 -0.6390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9425 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3862 0.3245 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4986 0.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0655 -0.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6325 0.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6325 0.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0655 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4986 0.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3862 -1.5040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8388 0.3244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5379 0.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2369 0.3245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9347 0.7275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6325 0.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9346 1.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1629 -1.1207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5516 -1.5332 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
3 24 1 0 0 0 0
24 25 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 24 25
M SBL 1 1 26
M SMT 1 OCH3
M SBV 1 26 -7.1294 5.7003
S SKP 8
ID FL2FA9NI0010
KNApSAcK_ID C00008183
NAME 5-Methoxy-7-prenyloxyflavanone
CAS_RN 96386-73-1
FORMULA C21H22O4
EXACTMASS 338.151809192
AVERAGEMASS 338.39698
SMILES COc(c3)c(c(cc3OCC=C(C)C)1)C(=O)CC(c(c2)cccc2)O1
M END
