Mol:FL1C19NP0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-1.3767 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3767 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8204 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2641 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2641 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8204 0.8602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2922 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8485 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4046 -0.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9607 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5217 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0827 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5217 0.8683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9607 0.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2922 -0.9259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8204 -1.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9330 0.8602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4893 0.5390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4893 -0.1034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9330 -0.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7941 1.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0827 0.3800 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 11 2 0 0 0 0
11 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 10 1 0 0 0 0
7 16 2 0 0 0 0
17 3 1 0 0 0 0
1 18 1 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 2 1 0 0 0 0
19 22 1 0 0 0 0
19 23 1 0 0 0 0
S SKP 8
ID FL1C19NP0002
KNApSAcK_ID C00007050
NAME Lonchocarpin
CAS_RN 31501-55-0
FORMULA C20H18O3
EXACTMASS 306.12559444199997
AVERAGEMASS 306.35512
SMILES c(c3O)(ccc(c32)OC(C=C2)(C)C)C(=O)C=Cc(c1)cccc1
M END
