Mol:FL2F1LNI0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 27 0 0 0 0 0 0 0 0999 V2000
-1.8426 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3217 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8008 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8008 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3217 -0.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8426 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2409 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2409 -0.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7613 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -1.7953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2957 -0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8300 -0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8300 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2957 0.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7613 0.5483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3635 -0.0684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3635 0.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3031 0.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8215 0.8733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8215 1.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3538 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2892 1.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2278 0.8563 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
3 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 4 1 0 0 0 0
9 11 1 0 0 0 0
7 12 2 0 0 0 0
11 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 11 1 0 0 0 0
6 18 1 0 0 0 0
15 19 1 0 0 0 0
20 21 1 0 0 0 0
21 22 2 0 0 0 0
22 23 1 0 0 0 0
22 24 1 0 0 0 0
20 5 1 0 0 0 0
17 25 1 0 0 0 0
S SKP 8
ID FL2F1LNI0002
KNApSAcK_ID C00008452
NAME Euchrenone a7
CAS_RN 130252-50-5
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES C(c(c3O)c(c(cc3)1)OC(c(c2)c(O)cc(O)c2)CC(=O)1)C=C(C)C
M END
