Mol:FL1C1ANP0017
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
29 32 0 0 0 0 0 0 0 0999 V2000
-4.2868 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2868 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5724 -1.0561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8579 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5724 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1434 -1.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4289 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4289 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1434 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7145 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4289 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4289 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 -1.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8579 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8579 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1434 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5724 -1.0561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2868 -0.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2868 0.1814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5724 0.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0993 -0.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5690 -1.4189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5690 -1.4189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0993 -0.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1434 1.4189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 1.4189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 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 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 5 1 0 0 0 0
9 11 1 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 16 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 14 1 0 0 0 0
17 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 2 0 0 0 0
23 18 1 0 0 0 0
21 24 1 0 0 0 0
21 25 1 0 0 0 0
2 26 1 0 0 0 0
2 27 1 0 0 0 0
10 28 1 0 0 0 0
11 29 2 0 0 0 0
S SKP 8
ID FL1C1ANP0017
KNApSAcK_ID C00014465
NAME Paratocarpin A;Bis(6'',6''-dimethylpyrano)[2'',3'':4',3'][2'',3'':4,3]-2'-hydroxychalcone
CAS_RN 161099-56-5
FORMULA C25H24O4
EXACTMASS 388.167459256
AVERAGEMASS 388.45565999999997
SMILES c(C(=O)C=Cc(c3)ccc(O4)c3C=CC4(C)C)(c1O)ccc(O2)c1C=CC2(C)C
M END
