http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL7AADGL0015
Mol:FL7AADGL0015 - Revision history
2026-07-23T09:02:21Z
Revision history for this page on the wiki
MediaWiki 1.19.1
http://metabolomics.jp/mediawiki/index.php?title=Mol:FL7AADGL0015&diff=192559&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:FL7AADGL0015&diff=192559&oldid=192558">Show changes</a>
Editor
http://metabolomics.jp/mediawiki/index.php?title=Mol:FL7AADGL0015&diff=192558&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 />
56 61 0 0 0 0 0 0 0 0999 V2000<br />
-2.9203 1.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.9203 1.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.3640 0.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.8077 1.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.8077 1.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.3640 2.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.2514 0.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.6951 1.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.6951 1.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.2514 2.1622 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0<br />
-0.1390 2.1621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4279 1.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.9949 2.1621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.9949 2.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4279 3.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.1390 2.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-3.4764 2.1621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.8609 3.3168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.3640 0.2354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.2790 0.4780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.2238 0.4542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
0.9556 -0.0104 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
1.4714 0.1371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.9903 -0.0104 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
2.2586 0.4542 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
1.7428 0.3068 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
0.8593 0.8188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.8845 0.8356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.5203 0.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.5400 0.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.1442 -0.4673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.1439 -1.1709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
3.4764 -1.7471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.5707 -1.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.2612 -1.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.5554 -1.8097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.2505 -2.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.6412 -2.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.3367 -1.8102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.6416 -1.2823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.2510 -1.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.2721 -1.8104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.3365 -2.8652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.7706 -2.9519 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br />
-1.4124 -3.4247 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.8966 -3.2241 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.3989 -3.2188 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br />
-0.7606 -2.8570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.2874 -3.0462 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br />
-2.2311 -2.9115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.7505 -3.8698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.6010 -3.7203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.7113 3.7203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.1526 4.6176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-1.5597 -2.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.5457 -2.1475 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 2 0 0 0 0<br />
8 9 1 0 0 0 0<br />
9 10 2 0 0 0 0<br />
10 5 1 0 0 0 0<br />
9 11 1 0 0 0 0<br />
11 12 2 0 0 0 0<br />
12 13 1 0 0 0 0<br />
13 14 2 0 0 0 0<br />
14 15 1 0 0 0 0<br />
15 16 2 0 0 0 0<br />
16 11 1 0 0 0 0<br />
1 17 1 0 0 0 0<br />
14 18 1 0 0 0 0<br />
3 19 1 0 0 0 0<br />
20 8 1 0 0 0 0<br />
21 22 1 0 0 0 0<br />
22 23 1 1 0 0 0<br />
23 24 1 1 0 0 0<br />
25 24 1 1 0 0 0<br />
25 26 1 0 0 0 0<br />
26 21 1 0 0 0 0<br />
21 27 1 0 0 0 0<br />
26 28 1 0 0 0 0<br />
25 29 1 0 0 0 0<br />
22 20 1 0 0 0 0<br />
24 30 1 0 0 0 0<br />
30 31 1 0 0 0 0<br />
31 32 1 0 0 0 0<br />
32 33 2 0 0 0 0<br />
32 34 1 0 0 0 0<br />
34 35 2 0 0 0 0<br />
35 36 1 0 0 0 0<br />
36 37 2 0 0 0 0<br />
37 38 1 0 0 0 0<br />
38 39 2 0 0 0 0<br />
39 40 1 0 0 0 0<br />
40 41 2 0 0 0 0<br />
41 36 1 0 0 0 0<br />
39 42 1 0 0 0 0<br />
38 43 1 0 0 0 0<br />
44 45 1 1 0 0 0<br />
45 46 1 1 0 0 0<br />
47 46 1 1 0 0 0<br />
47 48 1 0 0 0 0<br />
48 49 1 0 0 0 0<br />
49 44 1 0 0 0 0<br />
44 50 1 0 0 0 0<br />
45 51 1 0 0 0 0<br />
46 52 1 0 0 0 0<br />
47 43 1 0 0 0 0<br />
15 53 1 0 0 0 0<br />
53 54 1 0 0 0 0<br />
49 55 1 0 0 0 0<br />
55 56 1 0 0 0 0<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 55 56<br />
M SBL 2 1 60<br />
M SMT 2 CH2OH<br />
M SVB 2 60 -1.5597 -2.3142<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 53 54<br />
M SBL 1 1 58<br />
M SMT 1 OCH3<br />
M SVB 1 58 0.7113 3.7203<br />
S SKP 8<br />
ID FL7AADGL0015<br />
KNApSAcK_ID C00006863<br />
NAME Penidin 3-[6-(3-glucosylcaffeyl)glucoside]<br />
CAS_RN 175737-95-8<br />
FORMULA C37H39O19<br />
EXACTMASS 787.208554066<br />
AVERAGEMASS 787.69416<br />
SMILES c(c(O)6)c(c(c(c6)O)4)[o+1]c(c(c5)cc(c(c5)O)OC)c(c4)O[C@H](O1)C(O)C([C@H]([C@H]1COC(C=Cc(c2)ccc(O)c2O[C@H](O3)[C@H]([C@@H](O)[C@@H](O)C3CO)O)=O)O)O<br />
M END<br />
</pre></div>
Editor