Mol:FL5FDCGS0014
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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| − | 27 18 1 0 0 0 0 | + | 27 18 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL5FDCGS0014 | + | ID FL5FDCGS0014 |
| − | KNApSAcK_ID C00013901 | + | KNApSAcK_ID C00013901 |
| − | NAME Madreselvin A;Quercetin 3-methyl ether 7-gentiobioside;2-(3,4-Dihydroxyphenyl)-7-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-3-methoxy-4H-1-benzopyran-4-one | + | NAME Madreselvin A;Quercetin 3-methyl ether 7-gentiobioside;2-(3,4-Dihydroxyphenyl)-7-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-3-methoxy-4H-1-benzopyran-4-one |
| − | CAS_RN 188682-83-9 | + | CAS_RN 188682-83-9 |
| − | FORMULA C28H32O17 | + | FORMULA C28H32O17 |
| − | EXACTMASS 640.163949598 | + | EXACTMASS 640.163949598 |
| − | AVERAGEMASS 640.54348 | + | AVERAGEMASS 640.54348 |
| − | SMILES c(c1C(=C5OC)Oc(c(C5=O)4)cc(cc4O)OC(O2)C(O)C(O)C(O)C2COC(C(O)3)OC(C(O)C3O)CO)cc(c(c1)O)O | + | SMILES c(c1C(=C5OC)Oc(c(C5=O)4)cc(cc4O)OC(O2)C(O)C(O)C(O)C2COC(C(O)3)OC(C(O)C3O)CO)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
4.8056 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0911 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0911 1.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8056 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5200 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5200 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3766 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6622 0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9477 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9477 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6622 -1.4437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3766 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2332 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5187 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5187 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2332 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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S SKP 8
ID FL5FDCGS0014
KNApSAcK_ID C00013901
NAME Madreselvin A;Quercetin 3-methyl ether 7-gentiobioside;2-(3,4-Dihydroxyphenyl)-7-[(6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-3-methoxy-4H-1-benzopyran-4-one
CAS_RN 188682-83-9
FORMULA C28H32O17
EXACTMASS 640.163949598
AVERAGEMASS 640.54348
SMILES c(c1C(=C5OC)Oc(c(C5=O)4)cc(cc4O)OC(O2)C(O)C(O)C(O)C2COC(C(O)3)OC(C(O)C3O)CO)cc(c(c1)O)O
M END
