http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FFAGL0005
Mol:FL5FFAGL0005 - Revision history
2026-06-28T20:07:56Z
Revision history for this page on the wiki
MediaWiki 1.19.1
http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FFAGL0005&diff=190897&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:FL5FFAGL0005&diff=190897&oldid=190896">Show changes</a>
Editor
http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FFAGL0005&diff=190896&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 />
45 49 0 0 0 0 0 0 0 0999 V2000<br />
-2.8597 1.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.8597 0.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.3034 0.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.7471 0.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.7471 1.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.3034 1.5948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.1908 0.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.6345 0.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.6345 1.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.1908 1.5948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.1908 -0.1908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.0784 1.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4886 1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.0556 1.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.0556 2.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4886 2.5767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.0784 2.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-3.4158 1.5947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.2403 0.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.3034 -0.3321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.6895 2.6153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.1503 -0.8754 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
-0.4325 -0.5389 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.2476 -1.1860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.4325 -1.8370 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
0.1503 -2.1735 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.0346 -1.5264 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
-0.0172 -0.2505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4269 -1.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4861 -3.1154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.1846 0.4267 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br />
1.6270 -0.1572 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
2.2640 0.0905 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
2.8788 0.0971 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
2.4321 0.5439 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
1.8747 0.2498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.9373 -0.1908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.6291 -0.5223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.8700 -0.0351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.7837 -1.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.8932 -2.9852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.0254 2.1678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.5889 3.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.1891 1.1974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.0016 2.1796 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 />
8 19 1 0 0 0 0<br />
3 20 1 0 0 0 0<br />
21 15 1 0 0 0 0<br />
22 23 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 22 1 0 0 0 0<br />
22 28 1 0 0 0 0<br />
27 29 1 0 0 0 0<br />
26 30 1 0 0 0 0<br />
23 19 1 0 0 0 0<br />
31 32 1 1 0 0 0<br />
32 33 1 1 0 0 0<br />
34 33 1 1 0 0 0<br />
34 35 1 0 0 0 0<br />
35 36 1 0 0 0 0<br />
36 31 1 0 0 0 0<br />
32 37 1 0 0 0 0<br />
33 38 1 0 0 0 0<br />
28 31 1 0 0 0 0<br />
34 39 1 0 0 0 0<br />
25 40 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
6 42 1 0 0 0 0<br />
42 43 1 0 0 0 0<br />
35 44 1 0 0 0 0<br />
44 45 1 0 0 0 0<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 44 45<br />
M SBL 3 1 48<br />
M SMT 3 CH2OH<br />
M SVB 3 48 3.2523 0.2205<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 40 41<br />
M SBL 2 1 44<br />
M SMT 2 CH2OH<br />
M SVB 2 44 -0.7517 -2.05<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 42 43<br />
M SBL 1 1 46<br />
M SMT 1 OCH3<br />
M SVB 1 46 -2.0254 2.1678<br />
S SKP 8<br />
ID FL5FFAGL0005<br />
KNApSAcK_ID C00005357<br />
NAME Sexangularetin 3-sophoroside<br />
CAS_RN 114882-17-6<br />
FORMULA C28H32O17<br />
EXACTMASS 640.163949598<br />
AVERAGEMASS 640.54348<br />
SMILES [C@@H](CO)(O1)[C@H](O)C(C(O[C@@H](O5)[C@H](O)[C@@H]([C@@H](C5CO)O)O)[C@H](OC(C(=O)3)=C(Oc(c4OC)c(c(cc(O)4)O)3)c(c2)ccc(c2)O)1)O<br />
M END<br />
</pre></div>
Editor