Mol:FL3F98NS0016
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
29 31 0 0 0 0 0 0 0 0999 V2000
-1.1653 -1.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1653 -0.1762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8798 0.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5942 -0.1762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5942 -1.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8798 -1.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4508 -1.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2637 -1.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2636 -0.1761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4508 0.2363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9781 0.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6926 -0.1761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4070 0.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4070 1.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6925 1.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9781 1.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4508 -2.2387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1215 -0.1761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2156 -1.3599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8798 -2.0445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8360 -1.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6925 2.0644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1817 2.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8360 0.2364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3344 -2.3593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6926 -0.8425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2689 -1.1753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4303 1.3777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1163 1.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
1 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 2 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
13 18 1 0 0 0 0
5 19 1 0 0 0 0
6 20 1 0 0 0 0
19 21 1 0 0 0 0
15 22 1 0 0 0 0
22 23 1 0 0 0 0
18 24 1 0 0 0 0
20 25 1 0 0 0 0
12 26 1 0 0 0 0
26 27 1 0 0 0 0
16 28 1 0 0 0 0
28 29 1 0 0 0 0
S SKP 8
ID FL3F98NS0016
KNApSAcK_ID C00013342
NAME 5,6,2',3',5',6'-Hexamethoxyflavone;5,6-Dimethoxy-2-(2,3,5,6-tetramethoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 851383-32-9
FORMULA C21H22O8
EXACTMASS 402.13146768
AVERAGEMASS 402.39458
SMILES COc(c3)c(c(c(c3OC)OC)C(=C2)Oc(c1)c(C(=O)2)c(c(c1)OC)OC)OC
M END
