Mol:FL5FGAGS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
49 53 0 0 0 0 0 0 0 0999 V2000
4.5589 0.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8444 0.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8444 1.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5589 1.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2734 1.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2734 0.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1300 0.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4155 0.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7010 0.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7010 -0.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4155 -1.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1300 -0.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9865 0.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2721 0.1640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2721 -0.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9865 -1.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4155 -1.7805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4424 0.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9865 -1.8140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7786 -1.0355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4006 -0.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3981 -1.0480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0641 -0.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9865 1.2730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3657 1.6315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9157 1.7723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5142 1.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1119 0.7059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6993 -0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9010 0.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1075 -0.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5201 0.6882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3185 0.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4868 1.1073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9668 1.3845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4596 1.0535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5647 0.2230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7313 -0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0310 0.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6184 -0.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8200 -0.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0265 -0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4391 0.1600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2375 -0.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3945 0.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8743 0.8138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.5142 -0.3055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0670 -0.2780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9915 -0.9678 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
26 27 1 0 0 0 0
28 29 1 1 0 0 0
29 30 1 1 0 0 0
31 30 1 1 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
28 36 1 0 0 0 0
29 37 1 0 0 0 0
30 38 1 0 0 0 0
31 18 1 0 0 0 0
39 40 1 1 0 0 0
40 41 1 1 0 0 0
42 41 1 1 0 0 0
42 43 1 0 0 0 0
43 44 1 0 0 0 0
44 39 1 0 0 0 0
44 45 1 0 0 0 0
45 46 1 0 0 0 0
39 47 1 0 0 0 0
40 48 1 0 0 0 0
41 49 1 0 0 0 0
42 37 1 0 0 0 0
S SKP 8
ID FL5FGAGS0002
KNApSAcK_ID C00013993
NAME 5,7-Dihydroxy-3,6,8,4'-tetramethoxyflavone 7-glucosyl-(1->3)-galactoside;7-[(3-O-beta-D-Glucopyranosyl-D-galactopyranosyl)oxy]-5-hydroxy-3,6,8-trimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 205448-83-5
FORMULA C31H38O18
EXACTMASS 698.205814412
AVERAGEMASS 698.62262
SMILES C(O)C(C(O)5)OC(C(O)C(O)5)OC(C4O)C(O)C(OC(CO)4)Oc(c3OC)c(OC)c(O1)c(c3O)C(C(=C(c(c2)ccc(OC)c2)1)OC)=O
M END
