Mol:FL5FAAGS0119
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
46 50 0 0 0 0 0 0 0 0999 V2000
1.2941 3.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2941 2.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0086 1.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7230 2.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7230 3.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0086 3.5788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5796 1.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1348 2.3413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8493 1.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8493 1.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1348 0.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5796 1.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5638 2.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2782 1.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2782 1.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5638 0.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1348 -0.0269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9927 2.3413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1860 0.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3238 3.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5638 -0.0082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2633 -1.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5579 -1.6407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8505 -0.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4953 -0.3546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6740 -0.2761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3814 -1.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2278 -0.8204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7318 -1.0506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7480 -1.6438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1326 -2.2109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4647 -1.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6496 -2.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2371 -3.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4390 -2.9742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6458 -3.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0583 -2.4864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8564 -2.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0900 -3.5788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7740 -2.8733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3238 -2.8580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9915 -2.1911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3787 -1.9676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9005 -1.1100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3810 -1.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8893 -1.1261 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
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
12 19 1 0 0 0 0
5 20 1 0 0 0 0
16 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
22 30 1 0 0 0 0
23 31 1 0 0 0 0
24 32 1 0 0 0 0
25 19 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
35 39 1 0 0 0 0
34 40 1 0 0 0 0
33 41 1 0 0 0 0
38 42 1 0 0 0 0
42 43 1 0 0 0 0
43 45 1 0 0 0 0
44 45 2 0 0 0 0
45 46 1 0 0 0 0
36 31 1 0 0 0 0
S SKP 8
ID FL5FAAGS0119
KNApSAcK_ID C00013786
NAME Kaempferol 3-(6''-acetylglucosyl)-(1->3)-galactoside;Ricinitin;3-[[3-O-(6-O-Acetyl-beta-D-glucopyranosyl)-beta-D-galactopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 195702-53-5
FORMULA C29H32O17
EXACTMASS 652.163949598
AVERAGEMASS 652.55418
SMILES C(O)C(C4O)OC(C(C4OC(C5O)OC(C(C(O)5)O)COC(C)=O)O)OC(=C(c(c3)ccc(O)c3)1)C(=O)c(c2O)c(cc(c2)O)O1
M END
