Mol:FLIAAANP0006
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
30 33 0 0 0 0 0 0 0 0999 V2000
-2.6490 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6490 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0927 -0.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5364 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5364 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0927 0.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9801 -0.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4238 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4238 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9801 0.9463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1323 -0.3384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1323 -1.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7271 -1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3219 -1.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3219 -0.3384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7271 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9161 -1.3682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2053 0.9463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7616 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7616 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2053 -0.3385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7616 1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2870 0.3217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0927 -0.9806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5091 -1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1021 -1.3682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6951 -1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6951 -0.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2870 -1.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9801 -0.9806 0.0000 O 0 0 0 0 0 0 0 0 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
8 11 1 0 0 0 0
11 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 11 2 0 0 0 0
1 2 1 0 0 0 0
14 17 1 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 2 1 0 0 0 0
19 22 1 0 0 0 0
19 23 1 0 0 0 0
3 24 1 0 0 0 0
17 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 2 0 0 0 0
27 28 1 0 0 0 0
27 29 1 0 0 0 0
7 30 2 0 0 0 0
S SKP 8
ID FLIAAANP0006
KNApSAcK_ID C00009836
NAME 4'-O-Prenylalpinumisoflavone
CAS_RN 85985-76-8
FORMULA C25H24O5
EXACTMASS 404.162373878
AVERAGEMASS 404.45506
SMILES C(c(c4)ccc(c4)OCC=C(C)C)(C3=O)=COc(c31)cc(O2)c(C=CC2(C)C)c(O)1
M END
