Mol:FL5F2CNS0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-1.0716 -0.9553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0716 -0.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 0.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.9553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7861 -1.3678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3571 -1.3678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3574 -0.9553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -0.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3571 0.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.2824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 -0.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 1.5200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0716 1.1075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3571 -2.1928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2150 0.2822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0718 -1.3678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2150 1.5200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7861 2.1928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7851 -0.9559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2150 -1.3678 0.0000 O 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
4 18 1 0 0 0 0
8 19 1 0 0 0 0
14 20 1 0 0 0 0
15 21 1 0 0 0 0
19 22 1 0 0 0 0
5 23 1 0 0 0 0
S SKP 8
ID FL5F2CNS0003
KNApSAcK_ID C00013358
NAME 3-Methoxy-6,7,3',4'-tetrahydroxyflavone;2-(3,4-Dihydroxyphenyl)-6,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one
CAS_RN 159506-36-2
FORMULA C16H12O7
EXACTMASS 316.058302738
AVERAGEMASS 316.26228000000003
SMILES COC(C(=O)2)=C(Oc(c3)c(cc(O)c(O)3)2)c(c1)cc(O)c(O)c1
M END
