Mol:FLIDHXNS0010
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
23 27 0 0 0 0 0 0 0 0999 V2000
-2.2357 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2357 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6794 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1231 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1231 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6794 1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5668 -0.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0105 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0105 0.8362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5668 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5456 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5456 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1404 -1.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7352 -0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7352 -0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1404 0.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5610 -0.8138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7920 1.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5429 0.5133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3883 -1.0262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7920 -0.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3883 0.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1404 0.9023 0.0000 O 0 0 0 0 0 0 0 0 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
8 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 11 2 0 0 0 0
7 17 1 0 0 0 0
1 2 1 0 0 0 0
12 17 1 0 0 0 0
1 18 1 0 0 0 0
8 19 1 0 0 0 0
14 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 15 1 0 0 0 0
16 23 1 0 0 0 0
S SKP 8
ID FLIDHXNS0010
KNApSAcK_ID C00009679
NAME 6a,7-Dihydroxymaackiain;3,6a,7-Trihydroxy-8,9-methylenedioxypterocarpan
CAS_RN 61135-99-7
FORMULA C16H12O7
EXACTMASS 316.058302738
AVERAGEMASS 316.26228000000003
SMILES Oc(c5)cc(O4)c(c5)C(O1)C(O)(C4)c(c(O)2)c(cc(O3)c(OC3)2)1
M END
