Mol:FL3FAAGS0064
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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| − | 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 |
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| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
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| − | 39 42 1 0 0 0 0 | + | 39 42 1 0 0 0 0 |
| − | 31 23 1 0 0 0 0 | + | 31 23 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FAAGS0064 | + | ID FL3FAAGS0064 |
| − | KNApSAcK_ID C00013614 | + | KNApSAcK_ID C00013614 |
| − | NAME Apigenin 7-(2''-E-p-coumaroylglucoside;Echitin (glycoside);(E)-5-Hydroxy-2-(4-hydroxyphenyl)-7-[[2-O-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one | + | NAME Apigenin 7-(2''-E-p-coumaroylglucoside;Echitin (glycoside);(E)-5-Hydroxy-2-(4-hydroxyphenyl)-7-[[2-O-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one |
| − | CAS_RN 177535-49-8 | + | CAS_RN 177535-49-8 |
| − | FORMULA C30H26O12 | + | FORMULA C30H26O12 |
| − | EXACTMASS 578.1424262959999 | + | EXACTMASS 578.1424262959999 |
| − | AVERAGEMASS 578.5202400000001 | + | AVERAGEMASS 578.5202400000001 |
| − | SMILES O(C5CO)C(C(C(C5O)O)OC(=O)C=Cc(c4)ccc(c4)O)Oc(c3)cc(O1)c(c(O)3)C(C=C(c(c2)ccc(O)c2)1)=O | + | SMILES O(C5CO)C(C(C(C5O)O)OC(=O)C=Cc(c4)ccc(c4)O)Oc(c3)cc(O1)c(c(O)3)C(C=C(c(c2)ccc(O)c2)1)=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
-0.9176 1.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9176 0.9276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2032 0.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5113 0.9276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5113 1.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2032 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2258 0.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9403 0.9276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9403 1.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2258 2.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6547 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3692 1.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0837 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0837 2.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3692 3.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6547 2.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2258 -0.3099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2032 -0.3099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8300 3.4210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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20 1 1 0 0 0 0
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22 23 1 1 0 0 0
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25 26 1 0 0 0 0
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21 29 1 0 0 0 0
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24 20 1 0 0 0 0
31 32 1 0 0 0 0
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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 23 1 0 0 0 0
S SKP 8
ID FL3FAAGS0064
KNApSAcK_ID C00013614
NAME Apigenin 7-(2''-E-p-coumaroylglucoside;Echitin (glycoside);(E)-5-Hydroxy-2-(4-hydroxyphenyl)-7-[[2-O-[3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one
CAS_RN 177535-49-8
FORMULA C30H26O12
EXACTMASS 578.1424262959999
AVERAGEMASS 578.5202400000001
SMILES O(C5CO)C(C(C(C5O)O)OC(=O)C=Cc(c4)ccc(c4)O)Oc(c3)cc(O1)c(c(O)3)C(C=C(c(c2)ccc(O)c2)1)=O
M END
