Mol:FL2FDANS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
22 24 0 0 0 0 0 0 0 0999 V2000
-2.0735 0.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0735 -0.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5172 -0.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9609 -0.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9609 0.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5172 0.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4046 -0.8532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1517 -0.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1517 0.1104 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-0.4046 0.4316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7078 0.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2747 0.1041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8417 0.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8417 1.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2747 1.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7078 1.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4046 -1.3970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4308 1.4262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4308 0.7291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9309 1.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9537 -1.0137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2392 -1.4262 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
14 18 1 0 0 0 0
1 19 1 0 0 0 0
19 20 1 0 0 0 0
3 21 1 0 0 0 0
21 22 1 0 0 0 0
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 21 22
M SBL 2 1 23
M SMT 2 OCH3
M SVB 2 23 -1.9537 -1.0137
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 19 20
M SBL 1 1 21
M SMT 1 OCH3
M SVB 1 21 -2.4308 0.7291
S SKP 8
ID FL2FDANS0001
KNApSAcK_ID C00008227
NAME Naringenin 5,7-dimethyl ether
CAS_RN 72704-06-4
FORMULA C17H16O5
EXACTMASS 300.099773622
AVERAGEMASS 300.30593999999996
SMILES COc(c1)cc(O2)c(C(=O)CC2c(c3)ccc(O)c3)c(OC)1
M END
