Mol:FL2FA9NI0021
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 27 0 0 0 0 0 0 0 0999 V2000
-2.1425 -0.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1403 -1.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4233 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7117 -1.2374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7118 -0.4124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4272 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0064 -1.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7173 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7154 -0.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0026 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4298 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1426 -0.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8570 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8569 0.8317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1424 1.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4280 0.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0064 -2.4748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8570 -0.0032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1420 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1420 1.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4272 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4233 -2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8548 -1.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8566 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4276 2.4749 0.0000 C 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
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
1 18 1 0 0 0 0
6 21 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
3 22 1 0 0 0 0
2 23 1 0 0 0 0
19 24 1 0 0 0 0
19 25 1 0 0 0 0
S SKP 8
ID FL2FA9NI0021
KNApSAcK_ID C00014154
NAME 5,7-Dihydroxy-6-methyl-8-prenylflavanone
CAS_RN 116107-10-9
FORMULA C21H22O4
EXACTMASS 338.151809192
AVERAGEMASS 338.39698
SMILES c(c12)(C(=O)CC(c(c3)cccc3)O2)c(c(c(O)c1CC=C(C)C)C)O
M END
