Mol:FL2FA9NM0017
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 25 0 0 0 0 0 0 0 0999 V2000
-2.1450 0.3961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1438 -0.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4271 -0.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7148 -0.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7150 0.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4295 0.8105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0019 -0.8392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7141 -0.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7129 0.4002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0005 0.8108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4295 0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1429 0.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8573 0.8112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8572 1.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1427 2.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4283 1.6360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0024 -1.6642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4313 -1.6644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8573 0.8122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4295 1.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8052 -0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1176 -2.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9325 2.0607 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
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 6 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
3 18 1 0 0 0 0
1 19 1 0 0 0 0
6 20 1 0 0 0 0
2 21 1 0 0 0 0
18 22 1 0 0 0 0
20 23 2 0 0 0 0
S SKP 8
ID FL2FA9NM0017
KNApSAcK_ID C00014153
NAME Desmosflavanone II;7-Hydroxy-5-methoxy-6-methyl-8-formylflavanone
CAS_RN 219917-96-1
FORMULA C18H16O5
EXACTMASS 312.099773622
AVERAGEMASS 312.31664
SMILES O(C2c(c3)cccc3)c(c1C=O)c(C(=O)C2)c(c(c1O)C)OC
M END
