Mol:FL5FGAGS0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
48 52 0 0 0 0 0 0 0 0999 V2000
0.8942 -0.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1797 -0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1797 0.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8942 1.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6086 0.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6086 -0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5348 -0.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2492 -0.1894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9637 -0.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9637 -1.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2492 -1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5348 -1.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6782 -0.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3927 -0.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3927 -1.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6782 -1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2492 -2.5463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1071 -0.1894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6782 -2.5798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1139 -1.8014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7359 -1.4423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0628 -1.8138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7288 -1.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6782 0.5072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2990 0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2509 1.0065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3313 -2.9569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3576 0.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6008 0.1683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3731 -0.1218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8898 -0.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6467 -0.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8743 -0.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7678 0.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2446 0.1477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7288 0.2800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6069 -0.8472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5886 2.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1355 2.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6810 1.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8348 0.6225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2880 1.3122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7425 1.9316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1954 2.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2273 2.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9398 2.9569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1355 2.6887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0322 1.2990 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
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 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 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
16 19 1 0 0 0 0
12 20 1 0 0 0 0
20 21 1 0 0 0 0
15 22 1 0 0 0 0
22 23 1 0 0 0 0
13 24 1 0 0 0 0
24 25 1 0 0 0 0
5 26 1 0 0 0 0
19 27 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 1 0 0 0
31 30 1 1 0 0 0
32 31 1 1 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
28 34 1 0 0 0 0
33 35 1 0 0 0 0
32 36 1 0 0 0 0
31 37 1 0 0 0 0
29 26 1 0 0 0 0
38 39 1 1 0 0 0
39 40 1 1 0 0 0
41 40 1 1 0 0 0
41 42 1 0 0 0 0
42 43 1 0 0 0 0
43 38 1 0 0 0 0
43 44 1 0 0 0 0
44 45 1 0 0 0 0
38 46 1 0 0 0 0
39 47 1 0 0 0 0
40 48 1 0 0 0 0
35 41 1 0 0 0 0
S SKP 8
ID FL5FGAGS0003
KNApSAcK_ID C00013994
NAME 7,4'-Dihydroxy-3,5,6,8-tetramethoxyflavone 4'-glucosyl-(1->3)-galactoside
CAS_RN -
FORMULA C30H36O18
EXACTMASS 684.190164348
AVERAGEMASS 684.59604
SMILES C(O)(C5O)C(CO)OC(C5O)OC(C(O)1)C(C(OC1Oc(c4)ccc(c4)C(O3)=C(C(c(c32)c(c(c(c2OC)O)OC)OC)=O)OC)O)O
M END
