Editor at 00:00, 14 March 2009

2009-03-14T00:00:00Z

Editor at 00:00, 7 October 2008

2008-10-07T00:00:00Z

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<pre>

Copyright: ARM project http://www.metabolome.jp/
75 82 0 0 0 0 0 0 0 0999 V2000
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2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
1 18 1 0 0 0 0
15 19 1 0 0 0 0
8 20 1 0 0 0 0
21 22 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 21 1 0 0 0 0
21 27 1 0 0 0 0
26 28 1 0 0 0 0
25 29 1 0 0 0 0
22 20 1 0 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 34 1 0 0 0 0
34 35 1 1 0 0 0
35 30 1 1 0 0 0
35 36 1 0 0 0 0
30 37 1 0 0 0 0
31 38 1 0 0 0 0
32 39 1 0 0 0 0
34 27 1 0 0 0 0
3 40 1 0 0 0 0
41 42 1 1 0 0 0
42 43 1 1 0 0 0
44 43 1 1 0 0 0
44 45 1 0 0 0 0
45 46 1 0 0 0 0
46 41 1 0 0 0 0
41 47 1 0 0 0 0
42 48 1 0 0 0 0
43 49 1 0 0 0 0
44 18 1 0 0 0 0
49 50 1 0 0 0 0
50 51 2 0 0 0 0
50 52 1 0 0 0 0
52 53 2 0 0 0 0
53 54 1 0 0 0 0
54 55 2 0 0 0 0
55 56 1 0 0 0 0
56 57 2 0 0 0 0
57 58 1 0 0 0 0
58 59 2 0 0 0 0
59 54 1 0 0 0 0
57 60 1 0 0 0 0
61 62 1 1 0 0 0
62 63 1 1 0 0 0
64 63 1 1 0 0 0
64 65 1 0 0 0 0
65 66 1 0 0 0 0
66 61 1 0 0 0 0
61 67 1 0 0 0 0
62 68 1 0 0 0 0
63 69 1 0 0 0 0
64 48 1 0 0 0 0
24 70 1 0 0 0 0
70 71 1 0 0 0 0
46 72 1 0 0 0 0
72 73 1 0 0 0 0
66 74 1 0 0 0 0
74 75 1 0 0 0 0
M STY 1 3 SUP
M SLB 1 3 3
M SAL 3 2 74 75
M SBL 3 1 81
M SMT 3 CH2OH
M SVB 3 81 -4.4655 -1.0205
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 72 73
M SBL 2 1 79
M SMT 2 CH2OH
M SVB 2 79 -2.6529 2.1615
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 70 71
M SBL 1 1 77
M SMT 1 CH2OH
M SVB 1 77 2.9687 -2.2594
S SKP 8
ID FL5FAAGL0105
KNApSAcK_ID C00005926
NAME Kaempferol 3-neohesperidoside-7-(2''-p-coumaryllaminaribioside)
CAS_RN 173268-25-2
FORMULA C48H56O27
EXACTMASS 1064.300896586
AVERAGEMASS 1064.94204
SMILES c(c1O)cc(C(=C6O[C@@H](C(O[C@@H](O8)[C@H]([C@H](O)[C@@H](C8C)O)O)7)O[C@H](CO)[C@H](O)C(O)7)Oc(c(C6=O)5)cc(cc5O)O[C@@H]([C@H]2OC(C=Cc(c4)ccc(O)c4)=O)OC([C@@H]([C@@H]2O[C@H](O3)[C@H]([C@@H](O)[C@@H](O)C3CO)O)O)CO)cc1
M END
</pre>

Mol:FL5FAAGL0105 - Revision history

Editor at 00:00, 14 March 2009

Editor at 00:00, 7 October 2008