Mol:FL2FAANM0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
22 24 0 0 0 0 0 0 0 0999 V2000
-1.9452 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9452 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8326 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8326 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2763 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2800 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2800 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2763 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8361 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9700 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9700 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8361 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2763 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5368 0.4928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5013 -0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5368 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3889 1.1146 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 1 0 0 0 0
9 10 1 0 0 0 0
10 5 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 1 1 0 0 0 0
3 19 1 0 0 0 0
2 20 1 0 0 0 0
14 21 1 0 0 0 0
6 22 1 0 0 0 0
S SKP 8
ID FL2FAANM0002
KNApSAcK_ID C00008239
NAME Farrerol
CAS_RN 24211-30-1
FORMULA C17H16O5
EXACTMASS 300.099773622
AVERAGEMASS 300.30593999999996
SMILES Oc(c3)ccc(c3)C(C2)Oc(c(C)1)c(C(=O)2)c(O)c(C)c(O)1
M END
