Mol:FL6DF9NF0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
27 30 0 0 0 0 0 0 0 0999 V2000
0.9892 0.4730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2786 0.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4320 0.4730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4320 -0.3475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2786 -0.7578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9892 -0.3475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1426 0.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8532 0.4730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8532 -0.3475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1426 -0.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6336 0.7266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1159 0.0628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6336 -0.6011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8018 -0.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8018 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4588 -1.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1159 -1.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1159 -0.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4588 -0.4373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7033 0.8854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3701 0.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1426 -1.5786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8571 -1.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2786 1.5271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9930 1.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1426 1.5786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8571 1.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 1 1 0 0 0 0
3 7 2 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 4 2 0 0 0 0
8 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 9 1 0 0 0 0
7 26 1 0 0 0 0
2 24 1 1 0 0 0
10 22 1 0 0 0 0
6 14 1 1 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
19 14 1 0 0 0 0
1 20 1 6 0 0 0
20 21 1 0 0 0 0
22 23 1 0 0 0 0
24 25 1 0 0 0 0
26 27 1 0 0 0 0
S SKP 8
ID FL6DF9NF0001
KNApSAcK_ID C00013269
NAME Diplotropin;(5R,6S,7R)-rel-(+)-6,7-Dihydro-4,5,6,9-tetramethoxy-7-phenyl-5H-furo[3,2-g][1]benzopyran
CAS_RN 883238-76-4
FORMULA C21H22O6
EXACTMASS 370.141638436
AVERAGEMASS 370.39578
SMILES O(C)C(C3c(c4)cccc4)C(OC)c(c(OC)1)c(O3)c(OC)c(o2)c1cc2
M END
