Mol:FL1DA9NI0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 26 0 0 0 0 0 0 0 0999 V2000
-0.6483 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6483 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1836 -0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2812 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2812 0.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1836 0.8048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1836 -0.8048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7456 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2088 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6720 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1352 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5984 -0.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0616 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0616 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5984 0.8014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1352 0.5340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7456 -0.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1127 0.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6696 0.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1340 0.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5984 0.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0616 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5984 0.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7456 0.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4600 0.3921 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
3 7 1 0 0 0 0
4 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 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
8 17 2 0 0 0 0
1 18 1 0 0 0 0
19 20 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
21 23 1 0 0 0 0
18 19 1 0 0 0 0
5 24 1 0 0 0 0
24 25 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 24 25
M SBL 1 1 25
M SMT 1 OCH3
M SBV 1 25 -4.5317 4.8264
S SKP 8
ID FL1DA9NI0004
KNApSAcK_ID C00008007
NAME 2'-Hydroxy-6'-methoxy-4'-prenyloxydihydrochalcone
CAS_RN -
FORMULA C21H24O4
EXACTMASS 340.167459256
AVERAGEMASS 340.41285999999997
SMILES COc(c(C(=O)CCc(c2)cccc2)1)cc(cc1O)OCC=C(C)C
M END
