Mol:FL5FFANS0015
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
26 28 0 0 0 0 0 0 0 0999 V2000
-2.4197 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4197 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8633 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3070 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3070 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8633 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7507 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1944 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1944 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7507 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7507 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3617 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9286 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4956 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4956 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9286 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3617 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8633 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6716 -0.9911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5376 -1.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7769 0.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2769 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0624 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7769 1.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5853 1.0455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1488 1.9452 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
3 18 1 0 0 0 0
8 19 1 0 0 0 0
19 20 1 0 0 0 0
1 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
6 25 1 0 0 0 0
25 26 1 0 0 0 0
M STY 1 4 SUP
M SLB 1 4 4
M SAL 4 2 25 26
M SBL 4 1 27
M SMT 4 OCH3
M SVB 4 27 -1.5853 1.0455
M STY 1 3 SUP
M SLB 1 3 3
M SAL 3 2 23 24
M SBL 3 1 25
M SMT 3 OCH3
M SVB 3 25 2.0624 1.4543
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 -2.7769 0.77
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 0.0044 -0.6973
S SKP 8
ID FL5FFANS0015
KNApSAcK_ID C00004622
NAME Flindulatin;5-Hydroxy-3,4',7,8-tetramethoxyflavone;3,7,8,4'-Tetramethylherbacetin;5-Hydroxy-3,7,8-trimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 521-44-8
FORMULA C19H18O7
EXACTMASS 358.10525293
AVERAGEMASS 358.34202000000005
SMILES c(c1OC)(OC)cc(c(C2=O)c(OC(c(c3)ccc(OC)c3)=C2OC)1)O
M END
