Mol:FL4DAGNM0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
24 26 0 0 0 0 0 0 0 0999 V2000
-1.8429 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3220 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8011 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8011 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3220 0.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8429 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2802 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2407 -0.7709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2407 -0.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2802 0.1313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7610 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2802 -1.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2954 -0.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8298 0.1310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8298 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2954 1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7610 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3632 0.1310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3220 -1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7610 -1.0714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3632 1.0560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2954 1.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3632 -1.0714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3632 -0.1770 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 6 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
8 20 1 1 0 0 0
15 21 1 0 0 0 0
16 22 1 0 0 0 0
1 23 1 0 0 0 0
14 24 1 0 0 0 0
S SKP 8
ID FL4DAGNM0001
KNApSAcK_ID C00008596
NAME Cedrin
CAS_RN 75513-81-4
FORMULA C16H14O8
EXACTMASS 334.068867424
AVERAGEMASS 334.27756
SMILES Oc(c1)c(O)c(O)cc1C(O2)C(O)C(=O)c(c(O)3)c(cc(O)c(C)3)2
M END
