Mol:FL3FA9NF0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
22 25 0 0 0 0 0 0 0 0999 V2000
-0.4369 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4369 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1514 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8659 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8659 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1514 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2775 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9920 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9920 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2775 0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7065 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4209 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1354 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1354 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4209 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7065 1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2775 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1514 -1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6505 0.6674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1354 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6505 -0.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4369 -2.0625 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
18 6 1 0 0 0 0
4 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 5 1 0 0 0 0
18 22 1 0 0 0 0
S SKP 8
ID FL3FA9NF0002
KNApSAcK_ID C00013444
NAME Pinnatin;4-Methoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran-5-one
CAS_RN 1232-43-5
FORMULA C18H12O4
EXACTMASS 292.073558872
AVERAGEMASS 292.28548
SMILES O(C=3c(c4)cccc4)c(c2)c(C(=O)C3)c(c(c21)cco1)OC
M END
