Mol:FL5F1ANF0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
24 27 0 0 0 0 0 0 0 0999 V2000
-2.3596 0.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3596 -0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8033 -0.8829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2470 -0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2470 0.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8033 0.4018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6907 -0.8829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1344 -0.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1344 0.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6907 0.4018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6907 -1.3837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4217 0.4017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9887 0.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5557 0.4017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5557 1.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9887 1.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4217 1.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9368 1.0301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5757 1.0973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8370 0.5105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7316 -1.0617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5977 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1225 1.3836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8370 0.9711 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
6 18 1 0 0 0 0
18 19 2 0 0 0 0
19 20 1 0 0 0 0
20 1 1 0 0 0 0
8 21 1 0 0 0 0
21 22 1 0 0 0 0
15 23 1 0 0 0 0
23 24 1 0 0 0 0
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 23 24
M SBL 2 1 26
M SMT 2 OCH3
M SVB 2 26 2.1225 1.3836
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 21 22
M SBL 1 1 24
M SMT 1 OCH3
M SVB 1 24 0.0645 -0.768
S SKP 8
ID FL5F1ANF0001
KNApSAcK_ID C00005090
NAME 3,4'-Dimethoxyfurano[2,3:7,8]flavone
CAS_RN 70894-16-5
FORMULA C19H14O5
EXACTMASS 322.084123558
AVERAGEMASS 322.31146
SMILES c(c14)(occ4)ccc(C2=O)c(OC(c(c3)ccc(OC)c3)=C2OC)1
M END
