Mol:FL3FAAGS0066
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 42 46 0 0 0 0 0 0 0 0999 V2000 | + | 42 46 0 0 0 0 0 0 0 0999 V2000 |
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| − | 1.2186 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2186 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 1.9330 -2.3071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9330 -2.3071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -4.9048 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9048 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.7298 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.7298 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | -4.9048 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9048 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
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| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
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| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 20 1 1 0 0 0 0 | + | 20 1 1 0 0 0 0 |
| − | 21 22 1 1 0 0 0 | + | 21 22 1 1 0 0 0 |
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| − | 24 23 1 1 0 0 0 | + | 24 23 1 1 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 21 28 1 0 0 0 0 | + | 21 28 1 0 0 0 0 |
| − | 22 29 1 0 0 0 0 | + | 22 29 1 0 0 0 0 |
| − | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
| − | 24 20 1 0 0 0 0 | + | 24 20 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 33 2 0 0 0 0 | + | 32 33 2 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 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 36 37 2 0 0 0 0 | + | 36 37 2 0 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 38 39 2 0 0 0 0 | + | 38 39 2 0 0 0 0 |
| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
| − | 40 41 2 0 0 0 0 | + | 40 41 2 0 0 0 0 |
| − | 41 36 1 0 0 0 0 | + | 41 36 1 0 0 0 0 |
| − | 39 42 1 0 0 0 0 | + | 39 42 1 0 0 0 0 |
| − | 31 27 1 0 0 0 0 | + | 31 27 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FAAGS0066 | + | ID FL3FAAGS0066 |
| − | KNApSAcK_ID C00013616 | + | KNApSAcK_ID C00013616 |
| − | NAME Apigenin 7-(6''-E-p-coumaroylgalactoside);5-Hydroxy-2-(4-hydroxyphenyl)-7-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-galactopyranosyl]oxy]-4H-1-benzopyran-4-one | + | NAME Apigenin 7-(6''-E-p-coumaroylgalactoside);5-Hydroxy-2-(4-hydroxyphenyl)-7-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-galactopyranosyl]oxy]-4H-1-benzopyran-4-one |
| − | CAS_RN 480453-57-4 | + | CAS_RN 480453-57-4 |
| − | FORMULA C30H26O12 | + | FORMULA C30H26O12 |
| − | EXACTMASS 578.1424262959999 | + | EXACTMASS 578.1424262959999 |
| − | AVERAGEMASS 578.5202400000001 | + | AVERAGEMASS 578.5202400000001 |
| − | SMILES c(O)(c5)ccc(c5)C(O4)=CC(c(c34)c(cc(c3)OC(O1)C(C(O)C(C1COC(C=Cc(c2)ccc(O)c2)=O)O)O)O)=O | + | SMILES c(O)(c5)ccc(c5)C(O4)=CC(c(c34)c(cc(c3)OC(O1)C(C(O)C(C1COC(C=Cc(c2)ccc(O)c2)=O)O)O)O)=O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
42 46 0 0 0 0 0 0 0 0999 V2000
1.2186 -0.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2186 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9330 -1.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6475 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6475 -0.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9330 0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3620 -1.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0765 -1.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0765 -0.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3620 0.1679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7909 0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5054 -0.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2199 0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2199 0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5054 1.4054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7909 0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3620 -2.3071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9330 -2.3071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9662 1.4237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4990 0.1024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1460 0.2289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7334 -0.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9350 -0.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1416 -0.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5541 0.2112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3525 0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5208 0.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4937 0.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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-2.0206 0.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4326 1.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0206 2.3071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2564 1.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6684 0.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4923 0.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9048 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7298 1.5946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1423 0.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7298 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9048 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9662 0.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 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
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 11 1 0 0 0 0
7 17 2 0 0 0 0
3 18 1 0 0 0 0
14 19 1 0 0 0 0
20 1 1 0 0 0 0
21 22 1 1 0 0 0
22 23 1 1 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
26 27 1 0 0 0 0
21 28 1 0 0 0 0
22 29 1 0 0 0 0
23 30 1 0 0 0 0
24 20 1 0 0 0 0
31 32 1 0 0 0 0
32 33 2 0 0 0 0
32 34 1 0 0 0 0
34 35 2 0 0 0 0
35 36 1 0 0 0 0
36 37 2 0 0 0 0
37 38 1 0 0 0 0
38 39 2 0 0 0 0
39 40 1 0 0 0 0
40 41 2 0 0 0 0
41 36 1 0 0 0 0
39 42 1 0 0 0 0
31 27 1 0 0 0 0
S SKP 8
ID FL3FAAGS0066
KNApSAcK_ID C00013616
NAME Apigenin 7-(6''-E-p-coumaroylgalactoside);5-Hydroxy-2-(4-hydroxyphenyl)-7-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-galactopyranosyl]oxy]-4H-1-benzopyran-4-one
CAS_RN 480453-57-4
FORMULA C30H26O12
EXACTMASS 578.1424262959999
AVERAGEMASS 578.5202400000001
SMILES c(O)(c5)ccc(c5)C(O4)=CC(c(c34)c(cc(c3)OC(O1)C(C(O)C(C1COC(C=Cc(c2)ccc(O)c2)=O)O)O)O)=O
M END
