Mol:FL2FAANF0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
25 28 0 0 0 0 0 0 0 0999 V2000
-1.8767 0.1111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8582 -0.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0810 -1.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4262 -0.6768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4120 0.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1377 0.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3288 -1.1023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0026 -0.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9933 0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3095 0.5482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7078 0.5775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3989 0.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1102 0.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1307 1.4143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4190 1.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6986 1.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3288 -1.8440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0810 -1.7949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7993 1.8003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6470 0.3418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1044 -0.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6169 -0.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7993 -0.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1788 -1.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4607 -1.5418 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 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
14 19 1 0 0 0 0
1 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 2 1 0 0 0 0
21 23 1 0 0 0 0
22 24 1 0 0 0 0
22 25 1 0 0 0 0
S SKP 8
ID FL2FAANF0005
KNApSAcK_ID C00014210
NAME 5,4,-Dihydroxy-4'',4''-Dimethyl-5''-[2'',3'':7,6]methyldihydrofuranoflavanone
CAS_RN 192572-99-9
FORMULA C20H20O5
EXACTMASS 340.13107375
AVERAGEMASS 340.3698
SMILES Oc(c1)ccc(C(C4)Oc(c2)c(C(=O)4)c(c(C3(C)C)c2OC3C)O)c1
M END
