Mol:FL2FALNP0014
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
36 40 0 0 0 0 0 0 0 0999 V2000
-1.8535 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3326 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8117 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8117 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3326 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8535 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2908 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2300 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2300 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2908 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7504 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2908 -1.7262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2848 -0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8191 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8191 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2848 0.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7504 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3744 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3326 -1.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3535 0.9258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3326 0.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8530 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8530 1.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3734 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3326 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3739 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8942 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8942 -0.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8942 0.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5013 -0.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3535 -0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8879 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8879 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2459 1.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5013 0.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2169 0.9253 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
2 19 1 0 0 0 0
20 15 1 0 0 0 0
5 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 24 1 0 0 0 0
23 25 1 0 0 0 0
1 26 1 0 0 0 0
26 27 2 0 0 0 0
18 28 1 0 0 0 0
28 27 1 0 0 0 0
28 29 1 0 0 0 0
28 30 1 0 0 0 0
14 31 1 0 0 0 0
31 32 2 0 0 0 0
32 33 1 0 0 0 0
33 20 1 0 0 0 0
33 34 1 0 0 0 0
33 35 1 0 0 0 0
17 36 1 0 0 0 0
S SKP 8
ID FL2FALNP0014
KNApSAcK_ID C00008471
NAME Euchrenone a11
CAS_RN 137319-40-5
FORMULA C30H32O6
EXACTMASS 488.219888756
AVERAGEMASS 488.57148
SMILES O=C(c31)CC(c(c5O)cc(c4c5)C=CC(O4)(C)C)Oc1c(CC=C(C)C)c(c2c3O)OC(C=C2)(C)C
M END
