Mol:FL3FA9NR0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-0.4521 -1.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4521 -0.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1666 0.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1666 -1.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2624 -1.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9768 -1.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9768 -0.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2623 0.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9056 0.1530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6201 -0.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3346 0.1530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3346 0.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6201 1.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9056 0.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2624 -2.2882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8811 -1.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8811 -0.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6201 0.0434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3346 -0.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1666 0.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4093 1.1882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5911 2.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4608 2.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8165 1.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2176 0.8262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4608 2.7332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1303 2.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1666 -2.3207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8811 -2.7332 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 17 2 0 0 0 0
16 4 2 0 0 0 0
4 1 1 0 0 0 0
1 5 1 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
7 8 1 0 0 0 0
8 2 1 0 0 0 0
7 9 1 0 0 0 0
9 10 2 0 0 0 0
10 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 9 1 0 0 0 0
5 15 2 0 0 0 0
17 16 1 0 0 0 0
4 28 1 0 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
3 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 20 2 0 0 0 0
21 25 2 0 0 0 0
23 26 1 0 0 0 0
23 27 1 0 0 0 0
28 29 1 0 0 0 0
S SKP 8
ID FL3FA9NR0002
KNApSAcK_ID C00013474
NAME Hookerianin;8-(2,5-Dihydro-5,5-dimethyl-2-oxo-3-furanyl)-5,7-dimethoxy-2-phenyl-4H-1-benzopyran-4-one
CAS_RN 182232-34-4
FORMULA C23H20O6
EXACTMASS 392.125988372
AVERAGEMASS 392.4013
SMILES c(OC)(c3)c(C(C(=O)4)=CC(C)(C)O4)c(c(c(OC)3)2)OC(=CC(=O)2)c(c1)cccc1
M END
