Mol:FL1CHYNI0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 26 0 0 0 0 0 0 0 0999 V2000
-1.6765 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6765 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1202 0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5639 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5639 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1202 1.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0076 0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5487 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1048 0.1557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6609 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2219 0.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7829 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7829 1.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2219 1.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6609 1.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0076 -0.3458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1048 -0.4851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2328 0.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2328 -0.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7889 -0.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3438 -0.4873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7889 -1.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2326 1.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0078 1.4401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3438 1.4483 0.0000 O 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 1 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
9 17 2 0 0 0 0
18 2 1 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
20 22 1 0 0 0 0
1 23 1 0 0 0 0
5 24 1 0 0 0 0
13 25 1 0 0 0 0
S SKP 8
ID FL1CHYNI0002
KNApSAcK_ID C00007004
NAME 5'-Prenyllicodione
CAS_RN 107390-47-6
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES c(c1)(C(CC(=O)c(c2)ccc(O)c2)=O)c(cc(O)c1CC=C(C)C)O
M END
