Mol:FL5FAGGS0012
From Metabolomics.JP
(Difference between revisions)
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| − | 36 39 0 0 0 0 0 0 0 0999 V2000 | + | 36 39 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.1715 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1715 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1715 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1715 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6152 0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6152 0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0589 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0589 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0589 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0589 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6152 1.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6152 1.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5026 0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5026 0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0537 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0537 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0537 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0537 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5026 1.4606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5026 1.4606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5026 -0.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5026 -0.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6098 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6098 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1768 1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1768 1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7437 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7437 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7437 2.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7437 2.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1768 2.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1768 2.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6098 2.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6098 2.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7018 -0.0532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7018 -0.0532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3106 2.4424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3106 2.4424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6152 -0.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6152 -0.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7824 1.3379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7824 1.3379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1768 3.0970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1768 3.0970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3106 1.1332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3106 1.1332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3603 -1.3669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3603 -1.3669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8957 -1.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8957 -1.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7258 -1.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7258 -1.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8957 -0.4835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8957 -0.4835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3603 -0.1743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3603 -0.1743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5302 -0.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5302 -0.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1867 -0.7688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1867 -0.7688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4978 -1.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4978 -1.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7666 -2.1581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7666 -2.1581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2544 -1.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2544 -1.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3721 -2.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3721 -2.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7824 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7824 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5300 -3.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5300 -3.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 18 8 1 0 0 0 0 | + | 18 8 1 0 0 0 0 |
| − | 15 19 1 0 0 0 0 | + | 15 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 1 21 1 0 0 0 0 | + | 1 21 1 0 0 0 0 |
| − | 16 22 1 0 0 0 0 | + | 16 22 1 0 0 0 0 |
| − | 14 23 1 0 0 0 0 | + | 14 23 1 0 0 0 0 |
| − | 25 24 1 1 0 0 0 | + | 25 24 1 1 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 28 29 1 1 0 0 0 | + | 28 29 1 1 0 0 0 |
| − | 29 24 1 1 0 0 0 | + | 29 24 1 1 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
| − | 25 32 1 0 0 0 0 | + | 25 32 1 0 0 0 0 |
| − | 26 33 1 0 0 0 0 | + | 26 33 1 0 0 0 0 |
| − | 28 18 1 0 0 0 0 | + | 28 18 1 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 1 0 0 0 0 |
| − | 34 35 2 0 0 0 0 | + | 34 35 2 0 0 0 0 |
| − | 34 36 1 0 0 0 0 | + | 34 36 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FAGGS0012 | + | ID FL5FAGGS0012 |
| − | KNApSAcK_ID C00006041 | + | KNApSAcK_ID C00006041 |
| − | NAME Myricetin 3-acetylrhamnoside;Myricetin 3-O-(4''-acetyl)-alpha-L-rhamnopyranoside | + | NAME Myricetin 3-acetylrhamnoside;Myricetin 3-O-(4''-acetyl)-alpha-L-rhamnopyranoside |
| − | CAS_RN 165127-26-4 | + | CAS_RN 165127-26-4 |
| − | FORMULA C23H22O13 | + | FORMULA C23H22O13 |
| − | EXACTMASS 506.10604078999995 | + | EXACTMASS 506.10604078999995 |
| − | AVERAGEMASS 506.41298000000006 | + | AVERAGEMASS 506.41298000000006 |
| − | SMILES c(C(=O)2)(c4O)c(cc(c4)O)OC(=C2OC(C(O)3)OC(C(OC(C)=O)C(O)3)C)c(c1)cc(O)c(O)c(O)1 | + | SMILES c(C(=O)2)(c4O)c(cc(c4)O)OC(=C2OC(C(O)3)OC(C(OC(C)=O)C(O)3)C)c(c1)cc(O)c(O)c(O)1 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
36 39 0 0 0 0 0 0 0 0999 V2000
-2.1715 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1715 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6152 0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0589 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0589 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6152 1.4606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5026 0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0537 0.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0537 1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5026 1.4606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5026 -0.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6098 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1768 1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7437 1.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7437 2.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1768 2.4425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6098 2.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7018 -0.0532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3106 2.4424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6152 -0.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7824 1.3379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1768 3.0970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3106 1.1332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3603 -1.3669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8957 -1.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7258 -1.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8957 -0.4835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3603 -0.1743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5302 -0.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1867 -0.7688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4978 -1.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7666 -2.1581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2544 -1.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3721 -2.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7824 -2.0974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5300 -3.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
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
18 8 1 0 0 0 0
15 19 1 0 0 0 0
3 20 1 0 0 0 0
1 21 1 0 0 0 0
16 22 1 0 0 0 0
14 23 1 0 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 1 0 0 0
29 24 1 1 0 0 0
29 30 1 0 0 0 0
24 31 1 0 0 0 0
25 32 1 0 0 0 0
26 33 1 0 0 0 0
28 18 1 0 0 0 0
32 34 1 0 0 0 0
34 35 2 0 0 0 0
34 36 1 0 0 0 0
S SKP 8
ID FL5FAGGS0012
KNApSAcK_ID C00006041
NAME Myricetin 3-acetylrhamnoside;Myricetin 3-O-(4''-acetyl)-alpha-L-rhamnopyranoside
CAS_RN 165127-26-4
FORMULA C23H22O13
EXACTMASS 506.10604078999995
AVERAGEMASS 506.41298000000006
SMILES c(C(=O)2)(c4O)c(cc(c4)O)OC(=C2OC(C(O)3)OC(C(OC(C)=O)C(O)3)C)c(c1)cc(O)c(O)c(O)1
M END
