http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FACGL0074
Mol:FL5FACGL0074 - Revision history
2026-04-21T19:20:01Z
Revision history for this page on the wiki
MediaWiki 1.19.1
http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FACGL0074&diff=188857&oldid=prev
Editor at 00:00, 14 March 2009
2009-03-14T00:00:00Z
<p></p>
<a href="http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FACGL0074&diff=188857&oldid=188856">Show changes</a>
Editor
http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FACGL0074&diff=188856&oldid=prev
Editor at 00:00, 7 October 2008
2008-10-07T00:00:00Z
<p></p>
<p><b>New page</b></p><div><pre><br />
<br />
Copyright: ARM project http://www.metabolome.jp/<br />
67 73 0 0 0 0 0 0 0 0999 V2000<br />
-2.7577 1.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.7577 0.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.2014 0.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.6451 0.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.6451 1.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.2014 1.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.0888 0.0875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.5325 0.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.5325 1.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.0888 1.3722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.0888 -0.4133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.0236 1.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.5905 1.0448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.1575 1.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.1575 2.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.5905 2.3541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.0236 2.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-3.3138 1.3721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.7243 2.3540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.1384 0.0198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.2014 -0.5546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.5905 3.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.8802 -1.9779 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br />
-0.2981 -1.8276 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.3259 -1.2330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.0352 -0.7197 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.6737 -0.9451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.6173 -1.5648 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
-0.8802 -2.4507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.2981 -2.5840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.2075 -1.2257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.3074 -1.8466 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
0.6686 -1.8466 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
1.1278 -2.2908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.2847 -2.9138 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
1.9236 -2.9138 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
1.4644 -2.4696 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
1.9229 -2.2558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.2889 -3.0841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.2202 -0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.8171 -1.1576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.9342 -0.2590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.7453 -0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.9723 -0.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.4260 -0.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.6988 -0.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.2444 -0.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.5172 -0.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.2444 0.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.6988 0.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
4.0617 -0.3612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.5166 -1.3052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-3.7212 2.1926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-3.1533 1.8647 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-3.3335 2.4952 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
-3.1533 3.1296 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
-3.7212 3.4575 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-3.5411 2.8269 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br />
-3.7659 3.9678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.7989 3.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.9159 2.2541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.4593 -3.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.1738 -3.8198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.2250 -1.1519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.1253 -1.5872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-4.2173 3.0452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-4.9592 2.3746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1 2 1 0 0 0 0<br />
2 3 2 0 0 0 0<br />
3 4 1 0 0 0 0<br />
4 5 2 0 0 0 0<br />
5 6 1 0 0 0 0<br />
6 1 2 0 0 0 0<br />
4 7 1 0 0 0 0<br />
7 8 1 0 0 0 0<br />
8 9 2 0 0 0 0<br />
9 10 1 0 0 0 0<br />
10 5 1 0 0 0 0<br />
7 11 2 0 0 0 0<br />
9 12 1 0 0 0 0<br />
12 13 2 0 0 0 0<br />
13 14 1 0 0 0 0<br />
14 15 2 0 0 0 0<br />
15 16 1 0 0 0 0<br />
16 17 2 0 0 0 0<br />
17 12 1 0 0 0 0<br />
1 18 1 0 0 0 0<br />
15 19 1 0 0 0 0<br />
8 20 1 0 0 0 0<br />
3 21 1 0 0 0 0<br />
16 22 1 0 0 0 0<br />
23 24 1 1 0 0 0<br />
24 25 1 1 0 0 0<br />
26 25 1 1 0 0 0<br />
26 27 1 0 0 0 0<br />
27 28 1 0 0 0 0<br />
28 23 1 0 0 0 0<br />
23 29 1 0 0 0 0<br />
24 30 1 0 0 0 0<br />
25 31 1 0 0 0 0<br />
26 20 1 0 0 0 0<br />
32 33 1 0 0 0 0<br />
33 34 1 1 0 0 0<br />
34 35 1 1 0 0 0<br />
36 35 1 1 0 0 0<br />
36 37 1 0 0 0 0<br />
37 32 1 0 0 0 0<br />
37 38 1 0 0 0 0<br />
36 39 1 0 0 0 0<br />
33 31 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
41 32 1 0 0 0 0<br />
40 42 2 0 0 0 0<br />
40 43 1 0 0 0 0<br />
43 44 2 0 0 0 0<br />
44 45 1 0 0 0 0<br />
45 46 2 0 0 0 0<br />
46 47 1 0 0 0 0<br />
47 48 2 0 0 0 0<br />
48 49 1 0 0 0 0<br />
49 50 2 0 0 0 0<br />
50 45 1 0 0 0 0<br />
48 51 1 0 0 0 0<br />
47 52 1 0 0 0 0<br />
54 53 1 1 0 0 0<br />
54 55 1 0 0 0 0<br />
55 56 1 0 0 0 0<br />
56 57 1 0 0 0 0<br />
57 58 1 1 0 0 0<br />
58 53 1 1 0 0 0<br />
57 59 1 0 0 0 0<br />
56 60 1 0 0 0 0<br />
55 61 1 0 0 0 0<br />
18 54 1 0 0 0 0<br />
35 62 1 0 0 0 0<br />
62 63 1 0 0 0 0<br />
28 64 1 0 0 0 0<br />
64 65 1 0 0 0 0<br />
58 66 1 0 0 0 0<br />
66 67 1 0 0 0 0<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 66 67<br />
M SBL 3 1 72<br />
M SMT 3 CH2OH<br />
M SVB 3 72 -4.0617 3.3105<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 64 65<br />
M SBL 2 1 70<br />
M SMT 2 CH2OH<br />
M SVB 2 70 -1.225 -1.1519<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 62 63<br />
M SBL 1 1 68<br />
M SMT 1 CH2OH<br />
M SVB 1 68 1.4593 -3.4073<br />
S SKP 8<br />
ID FL5FACGL0074<br />
KNApSAcK_ID C00005996<br />
NAME Quercetin 3-(2'''-(E)-caffeylsophoroside]-7-glucoside<br />
CAS_RN 151649-67-1<br />
FORMULA C42H46O25<br />
EXACTMASS 950.2328170220001<br />
AVERAGEMASS 950.79964<br />
SMILES [C@@H](CO)(O1)[C@H](O)C(C(OC(=O)C=Cc(c7)ccc(O)c7O)[C@H](O[C@@H]([C@@H](O)6)[C@@H](OC(CO)[C@@H]6O)OC(C2=O)=C(c(c5)cc(O)c(O)c5)Oc(c3)c(c(cc3O[C@@H](O4)C(C([C@H](O)[C@@H]4CO)O)O)O)2)1)O<br />
M END<br />
</pre></div>
Editor