Mol:FL5FAAGS0050
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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− | 2.2654 -0.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2654 -0.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
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− | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
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− | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
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− | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
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− | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
− | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
− | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
− | 28 32 1 0 0 0 0 | + | 28 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 |
− | S SKP 8 | + | S SKP 8 |
− | ID FL5FAAGS0050 | + | ID FL5FAAGS0050 |
− | KNApSAcK_ID C00005863 | + | KNApSAcK_ID C00005863 |
− | NAME Kaempferol 3-(2-(E)-p-coumarylrhamnoside);3-[[6-Deoxy-2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-alpha-L-mannopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one | + | NAME Kaempferol 3-(2-(E)-p-coumarylrhamnoside);3-[[6-Deoxy-2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-alpha-L-mannopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one |
− | CAS_RN 151455-10-6 | + | CAS_RN 151455-10-6 |
− | FORMULA C30H26O12 | + | FORMULA C30H26O12 |
− | EXACTMASS 578.1424262959999 | + | EXACTMASS 578.1424262959999 |
− | AVERAGEMASS 578.5202400000001 | + | AVERAGEMASS 578.5202400000001 |
− | SMILES c(C(=C(OC(O5)C(C(O)C(C5C)O)OC(=O)C=Cc(c4)ccc(c4)O)2)Oc(c3)c(c(O)cc3O)C2=O)(c1)ccc(c1)O | + | SMILES c(C(=C(OC(O5)C(C(O)C(C5C)O)OC(=O)C=Cc(c4)ccc(c4)O)2)Oc(c3)c(c(O)cc3O)C2=O)(c1)ccc(c1)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 -3.8151 0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8151 0.1764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2588 -0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7025 0.1764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7025 0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2588 1.1400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1462 -0.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5899 0.1764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5899 0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1462 1.1400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1462 -0.6456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8894 1.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3224 0.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2445 1.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2445 1.9183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3224 2.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8894 1.9183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2588 -0.7869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 2.2976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3101 1.1400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0266 -0.2331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -1.2856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3862 -1.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1869 -0.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3862 -0.2491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 0.1137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0427 -0.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7276 -0.5839 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0806 -1.8878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3862 -2.2976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8071 -1.3089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1809 -0.1306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1809 0.3032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7994 -0.4877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2654 -0.2187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8629 -0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8629 -1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3454 -1.3992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8278 -1.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8278 -0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3454 -0.2851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3101 -1.3991 0.0000 O 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 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 3 18 1 0 0 0 0 19 15 1 0 0 0 0 20 1 1 0 0 0 0 21 8 1 0 0 0 0 4 3 1 0 0 0 0 23 22 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 1 0 0 0 27 22 1 1 0 0 0 27 28 1 0 0 0 0 22 29 1 0 0 0 0 23 30 1 0 0 0 0 24 31 1 0 0 0 0 26 21 1 0 0 0 0 28 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 S SKP 8 ID FL5FAAGS0050 KNApSAcK_ID C00005863 NAME Kaempferol 3-(2-(E)-p-coumarylrhamnoside);3-[[6-Deoxy-2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-alpha-L-mannopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one CAS_RN 151455-10-6 FORMULA C30H26O12 EXACTMASS 578.1424262959999 AVERAGEMASS 578.5202400000001 SMILES c(C(=C(OC(O5)C(C(O)C(C5C)O)OC(=O)C=Cc(c4)ccc(c4)O)2)Oc(c3)c(c(O)cc3O)C2=O)(c1)ccc(c1)O M END