Mol:FL3FBDNS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-1.9630 -0.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9630 -0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 -1.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8504 -0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8504 -0.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4067 0.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2941 -1.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2622 -0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2622 -0.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2941 0.1499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2941 -1.6357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8183 0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3853 -0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9523 0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9523 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3853 1.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8183 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5191 0.1497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9523 0.8044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6687 1.7079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1101 2.6052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8431 -1.2954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1286 -1.7079 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
1 18 1 0 0 0 0
15 19 1 0 0 0 0
16 20 1 0 0 0 0
20 21 1 0 0 0 0
3 22 1 0 0 0 0
22 23 1 0 0 0 0
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 22 23
M SBL 2 1 24
M SMT 2 OCH3
M SVB 2 24 -1.8431 -1.2954
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 20 21
M SBL 1 1 22
M SMT 1 OCH3
M SVB 1 22 1.6687 1.7079
S SKP 8
ID FL3FBDNS0001
KNApSAcK_ID C00003866
NAME Luteolin 5,3'-dimethyl ether;Chrysoeriol 5-methyl ether;7-Hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-4H-1-benzopyran-4-one
CAS_RN 62346-14-9
FORMULA C17H14O6
EXACTMASS 314.07903818
AVERAGEMASS 314.28945999999996
SMILES COc(c(O)3)cc(cc3)C(=C2)Oc(c1)c(C(=O)2)c(OC)cc(O)1
M END
