Mol:FL5FDCGS0015
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 45 49 0 0 0 0 0 0 0 0999 V2000 | + | 45 49 0 0 0 0 0 0 0 0999 V2000 |
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| − | 36 44 1 0 0 0 0 | + | 36 44 1 0 0 0 0 |
| − | 37 45 1 0 0 0 0 | + | 37 45 1 0 0 0 0 |
| − | 38 32 1 0 0 0 0 | + | 38 32 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FDCGS0015 | + | ID FL5FDCGS0015 |
| − | KNApSAcK_ID C00013902 | + | KNApSAcK_ID C00013902 |
| − | NAME Quercetin 3-methyl ether 7-galactosyl-(1->4)-glucoside;2-(3,4-Dihydroxyphenyl)-7-[(4-O-beta-D-galactopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-3-methoxy-4H-1-benzopyran-4-one | + | NAME Quercetin 3-methyl ether 7-galactosyl-(1->4)-glucoside;2-(3,4-Dihydroxyphenyl)-7-[(4-O-beta-D-galactopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-3-methoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 475587-76-9 | + | CAS_RN 475587-76-9 |
| − | FORMULA C28H32O17 | + | FORMULA C28H32O17 |
| − | EXACTMASS 640.163949598 | + | EXACTMASS 640.163949598 |
| − | AVERAGEMASS 640.54348 | + | AVERAGEMASS 640.54348 |
| − | SMILES c(c1C(=C5OC)Oc(c(C5=O)2)cc(OC(C(O)3)OC(CO)C(OC(O4)C(O)C(C(O)C4CO)O)C3O)cc2O)cc(c(c1)O)O | + | SMILES c(c1C(=C5OC)Oc(c(C5=O)2)cc(OC(C(O)3)OC(CO)C(OC(O4)C(O)C(C(O)C4CO)O)C3O)cc2O)cc(c(c1)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/
45 49 0 0 0 0 0 0 0 0999 V2000
4.8724 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1580 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1580 1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8724 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5869 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5869 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4435 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7290 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0145 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0145 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7290 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4435 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3001 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5856 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5856 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3001 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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38 32 1 0 0 0 0
S SKP 8
ID FL5FDCGS0015
KNApSAcK_ID C00013902
NAME Quercetin 3-methyl ether 7-galactosyl-(1->4)-glucoside;2-(3,4-Dihydroxyphenyl)-7-[(4-O-beta-D-galactopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-3-methoxy-4H-1-benzopyran-4-one
CAS_RN 475587-76-9
FORMULA C28H32O17
EXACTMASS 640.163949598
AVERAGEMASS 640.54348
SMILES c(c1C(=C5OC)Oc(c(C5=O)2)cc(OC(C(O)3)OC(CO)C(OC(O4)C(O)C(C(O)C4CO)O)C3O)cc2O)cc(c(c1)O)O
M END
