Mol:FL2FA8NS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
21 23 0 0 0 0 0 0 0 0999 V2000
-1.6795 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6795 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1232 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5669 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5669 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1232 0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0106 -0.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5457 -0.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5457 0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0106 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1018 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6688 0.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2358 0.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2358 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6688 1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1018 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0106 -1.3560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1232 -1.4544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5350 1.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2358 0.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6688 -0.5095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 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 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
3 18 1 0 0 0 0
16 19 1 0 0 0 0
20 1 1 0 0 0 0
12 21 1 0 0 0 0
S SKP 8
ID FL2FA8NS0001
KNApSAcK_ID C00008338
NAME 5,7,2',6'-Tetrahydroxyflavanone
CAS_RN 80604-16-6
FORMULA C15H12O6
EXACTMASS 288.063388116
AVERAGEMASS 288.25218
SMILES Oc(c3)cc(O1)c(c(O)3)C(=O)CC1c(c(O)2)c(O)ccc2
M END
